N-[3-oxidanylidene-2-phenyl-3-[(phenylmethyl)amino]-1-thiophen-2-yl-propyl]pyrazine-2-carboxamide

Systemtic Name: N-[3-oxidanylidene-2-phenyl-3-[(phenylmethyl)amino]-1-thiophen-2-yl-propyl]pyrazine-2-carboxamide Openeye Name: N-[3-(benzylamino)-3-oxo-2-phenyl-1-(2-thienyl)propyl]pyrazine-2-carboxamide CAS Name: N-[3-oxo-2-phenyl-3-[(phenylmethyl)amino]-1-thiophen-2-ylpropyl]-2-pyrazinecarboxamide IUPAC Name: N-[3-(benzylamino)-3-oxo-2-phenyl-1-thiophen-2-ylpropyl]pyrazine-2-carboxamide Traditional Name: N-[3-(benzylamino)-3-keto-2-phenyl-1-(2-thienyl)propyl]pyrazinamide Formula: C25H22N4O2S MolecularWeight: 442.53278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C(C2=CC=CC=C2)C(C3=CC=CS3)NC(=O)C4=NC=CN=C4

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C(C2=CC=CC=C2)C(C3=CC=CS3)NC(=O)C4=NC=CN=C4

InChI

InChI=1S/C25H22N4O2S/c30-24(20-17-26-13-14-27-20)29-23(21-12-7-15-32-21)22(19-10-5-2-6-11-19)25(31)28-16-18-8-3-1-4-9-18/h1-15,17,22-23H,16H2,(H,28,31)(H,29,30)