N-(2-aminophenyl)-5-[(2-cyclohexylpropanoylamino)methyl]thiophene-2-carboxamide

Systemtic Name: N-(2-aminophenyl)-5-[(2-cyclohexylpropanoylamino)methyl]thiophene-2-carboxamide Openeye Name: N-(2-aminophenyl)-5-[(2-cyclohexylpropanoylamino)methyl]thiophene-2-carboxamide CAS Name: N-(2-aminophenyl)-5-[[(2-cyclohexyl-1-oxopropyl)amino]methyl]-2-thiophenecarboxamide IUPAC Name: N-(2-aminophenyl)-5-[(2-cyclohexylpropanoylamino)methyl]thiophene-2-carboxamide Traditional Name: N-(2-aminophenyl)-5-[(2-cyclohexylpropanoylamino)methyl]thiophene-2-carboxamide Formula: C21H27N3O2S MolecularWeight: 385.52298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCCC1)C(=O)NCC2=CC=C(S2)C(=O)NC3=CC=CC=C3N

Isomeric SMILES

CC(C1CCCCC1)C(=O)NCC2=CC=C(S2)C(=O)NC3=CC=CC=C3N

InChI

InChI=1S/C21H27N3O2S/c1-14(15-7-3-2-4-8-15)20(25)23-13-16-11-12-19(27-16)21(26)24-18-10-6-5-9-17(18)22/h5-6,9-12,14-15H,2-4,7-8,13,22H2,1H3,(H,23,25)(H,24,26)