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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)N)N(CC2=CC=CC=C2NC(=O)C3=CC=CS3)C(=O)C4CC4

Isomeric SMILES

C1CCC(C(C1)N)N(CC2=CC=CC=C2NC(=O)C3=CC=CS3)C(=O)C4CC4

InChI

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