N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-[(diphenylmethyl)amino]propanamide

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-[(diphenylmethyl)amino]propanamide Openeye Name: 3-(benzhydrylamino)-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)propanamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-[(diphenylmethyl)amino]propanamide IUPAC Name: 3-(benzhydrylamino)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)propanamide Traditional Name: 3-(benzhydrylamino)-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)propionamide Formula: C25H25N3OS MolecularWeight: 415.5505

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)CCNC(C3=CC=CC=C3)C4=CC=CC=C4)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)CCNC(C3=CC=CC=C3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C25H25N3OS/c26-17-21-20-13-7-8-14-22(20)30-25(21)28-23(29)15-16-27-24(18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-6,9-12,24,27H,7-8,13-16H2,(H,28,29)