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

Systemtic Name: N-[4-[[(4-azanylcyclohexyl)-cyclohexylcarbonyl-amino]methyl]phenyl]thiophene-2-carboxamide Openeye Name: N-[4-[[(4-aminocyclohexyl)-(cyclohexanecarbonyl)amino]methyl]phenyl]thiophene-2-carboxamide CAS Name: N-[4-[[(4-aminocyclohexyl)-[cyclohexyl(oxo)methyl]amino]methyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[[(4-aminocyclohexyl)-(cyclohexanecarbonyl)amino]methyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[4-[[(4-aminocyclohexyl)-(cyclohexanecarbonyl)amino]methyl]phenyl]thiophene-2-carboxamide Formula: C25H33N3O2S MolecularWeight: 439.61342

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N(CC2=CC=C(C=C2)NC(=O)C3=CC=CS3)C4CCC(CC4)N

Isomeric SMILES

C1CCC(CC1)C(=O)N(CC2=CC=C(C=C2)NC(=O)C3=CC=CS3)C4CCC(CC4)N

InChI

InChI=1S/C25H33N3O2S/c26-20-10-14-22(15-11-20)28(25(30)19-5-2-1-3-6-19)17-18-8-12-21(13-9-18)27-24(29)23-7-4-16-31-23/h4,7-9,12-13,16,19-20,22H,1-3,5-6,10-11,14-15,17,26H2,(H,27,29)