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

Systemtic Name: N-[4-[[(4-azanylcyclohexyl)-cyclopropylcarbonyl-amino]methyl]phenyl]thiophene-2-carboxamide Openeye Name: N-[4-[[(4-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]phenyl]thiophene-2-carboxamide CAS Name: N-[4-[[(4-aminocyclohexyl)-[cyclopropyl(oxo)methyl]amino]methyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[[(4-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[4-[[(4-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]phenyl]thiophene-2-carboxamide Formula: C22H27N3O2S MolecularWeight: 397.53368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O2S/c23-17-7-11-19(12-8-17)25(22(27)16-5-6-16)14-15-3-9-18(10-4-15)24-21(26)20-2-1-13-28-20/h1-4,9-10,13,16-17,19H,5-8,11-12,14,23H2,(H,24,26)