N-[2-[2-[(4-azanylcyclohexyl)amino]-2-oxidanylidene-ethyl]phenyl]-3-chloranyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[2-[2-[(4-azanylcyclohexyl)amino]-2-oxidanylidene-ethyl]phenyl]-3-chloranyl-1-benzothiophene-2-carboxamide Openeye Name: N-[2-[2-[(4-aminocyclohexyl)amino]-2-oxo-ethyl]phenyl]-3-chloro-benzothiophene-2-carboxamide CAS Name: N-[2-[2-[(4-aminocyclohexyl)amino]-2-oxoethyl]phenyl]-3-chloro-1-benzothiophene-2-carboxamide IUPAC Name: N-[2-[2-[(4-aminocyclohexyl)amino]-2-oxoethyl]phenyl]-3-chloro-1-benzothiophene-2-carboxamide Traditional Name: N-[2-[2-[(4-aminocyclohexyl)amino]-2-keto-ethyl]phenyl]-3-chloro-benzothiophene-2-carboxamide Formula: C23H24ClN3O2S MolecularWeight: 441.97356

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)NC(=O)CC2=CC=CC=C2NC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

C1CC(CCC1N)NC(=O)CC2=CC=CC=C2NC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C23H24ClN3O2S/c24-21-17-6-2-4-8-19(17)30-22(21)23(29)27-18-7-3-1-5-14(18)13-20(28)26-16-11-9-15(25)10-12-16/h1-8,15-16H,9-13,25H2,(H,26,28)(H,27,29)