N-[4-[[4-[(4-azanylcyclohexyl)methyl]cyclohexyl]carbamoyl]-3-chloranyl-phenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: N-[4-[[4-[(4-azanylcyclohexyl)methyl]cyclohexyl]carbamoyl]-3-chloranyl-phenyl]-1-benzothiophene-2-carboxamide Openeye Name: N-[4-[[4-[(4-aminocyclohexyl)methyl]cyclohexyl]carbamoyl]-3-chloro-phenyl]benzothiophene-2-carboxamide CAS Name: N-[4-[[[4-[(4-aminocyclohexyl)methyl]cyclohexyl]amino]-oxomethyl]-3-chlorophenyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-[4-[[4-[(4-aminocyclohexyl)methyl]cyclohexyl]carbamoyl]-3-chlorophenyl]-1-benzothiophene-2-carboxamide Traditional Name: N-[4-[[4-[(4-aminocyclohexyl)methyl]cyclohexyl]carbamoyl]-3-chloro-phenyl]benzothiophene-2-carboxamide Formula: C29H34ClN3O2S MolecularWeight: 524.11716

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CC2CCC(CC2)NC(=O)C3=C(C=C(C=C3)NC(=O)C4=CC5=CC=CC=C5S4)Cl)N

Isomeric SMILES

C1CC(CCC1CC2CCC(CC2)NC(=O)C3=C(C=C(C=C3)NC(=O)C4=CC5=CC=CC=C5S4)Cl)N

InChI

InChI=1S/C29H34ClN3O2S/c30-25-17-23(33-29(35)27-16-20-3-1-2-4-26(20)36-27)13-14-24(25)28(34)32-22-11-7-19(8-12-22)15-18-5-9-21(31)10-6-18/h1-4,13-14,16-19,21-22H,5-12,15,31H2,(H,32,34)(H,33,35)