N-[(2S)-1-oxidanylidene-3-phenyl-1-[[4-(piperidin-1-ylmethyl)phenyl]methylamino]propan-2-yl]thiophene-2-carboxamide

Systemtic Name: N-[(2S)-1-oxidanylidene-3-phenyl-1-[[4-(piperidin-1-ylmethyl)phenyl]methylamino]propan-2-yl]thiophene-2-carboxamide Openeye Name: N-[(1S)-1-benzyl-2-oxo-2-[[4-(1-piperidylmethyl)phenyl]methylamino]ethyl]thiophene-2-carboxamide CAS Name: N-[(2S)-1-oxo-3-phenyl-1-[[4-(1-piperidinylmethyl)phenyl]methylamino]propan-2-yl]-2-thiophenecarboxamide IUPAC Name: N-[(2S)-1-oxo-3-phenyl-1-[[4-(piperidin-1-ylmethyl)phenyl]methylamino]propan-2-yl]thiophene-2-carboxamide Traditional Name: N-[(1S)-1-benzyl-2-keto-2-[[4-(piperidinomethyl)benzyl]amino]ethyl]thiophene-2-carboxamide Formula: C27H31N3O2S MolecularWeight: 461.61894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=C(C=C2)CNC(=O)C(CC3=CC=CC=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

C1CCN(CC1)CC2=CC=C(C=C2)CNC(=O)[C@H](CC3=CC=CC=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C27H31N3O2S/c31-26(28-19-22-11-13-23(14-12-22)20-30-15-5-2-6-16-30)24(18-21-8-3-1-4-9-21)29-27(32)25-10-7-17-33-25/h1,3-4,7-14,17,24H,2,5-6,15-16,18-20H2,(H,28,31)(H,29,32)/t24-/m0/s1