N-[3-[[(4-azanylcyclohexyl)-cyclopropylcarbonyl-amino]methyl]-4-chloranyl-phenyl]thiophene-2-carboxamide

Systemtic Name: N-[3-[[(4-azanylcyclohexyl)-cyclopropylcarbonyl-amino]methyl]-4-chloranyl-phenyl]thiophene-2-carboxamide Openeye Name: N-[3-[[(4-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]-4-chloro-phenyl]thiophene-2-carboxamide CAS Name: N-[3-[[(4-aminocyclohexyl)-[cyclopropyl(oxo)methyl]amino]methyl]-4-chlorophenyl]-2-thiophenecarboxamide IUPAC Name: N-[3-[[(4-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]-4-chlorophenyl]thiophene-2-carboxamide Traditional Name: N-[3-[[(4-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]-4-chloro-phenyl]thiophene-2-carboxamide Formula: C22H26ClN3O2S MolecularWeight: 431.97874

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N(CC2=C(C=CC(=C2)NC(=O)C3=CC=CS3)Cl)C4CCC(CC4)N

Isomeric SMILES

C1CC1C(=O)N(CC2=C(C=CC(=C2)NC(=O)C3=CC=CS3)Cl)C4CCC(CC4)N

InChI

InChI=1S/C22H26ClN3O2S/c23-19-10-7-17(25-21(27)20-2-1-11-29-20)12-15(19)13-26(22(28)14-3-4-14)18-8-5-16(24)6-9-18/h1-2,7,10-12,14,16,18H,3-6,8-9,13,24H2,(H,25,27)