N-(azepane-1-carbothioyl)-4-nitro-benzamide
Molecular Formula:
C
14
H
17
N
3
O
3
S
InChI:
InChI=1/C14H17N3O3S/c18-13(11-5-7-12(8-6-11)17(19)20)15-14(21)16-9-3-1-2-4-10-16/h5-8H,1-4,9-10H2,(H,15,18,21)/f/h15H
InChIKey:
InChIKey=LFKAELBBKHVQJD-YAQRNVERCI
SMILES:
C1CCCN(CC1)C(=S)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-]
Names:
N-(azepane-1-carbothioyl)-4-nitro-benzamide
Registries:
PubChem CID 782866
PubChem ID 8216070