N-[2-(4-methoxyphenyl)-3-oxidanylidene-3-[(phenylmethyl)amino]-1-thiophen-2-yl-propyl]pyrazine-2-carboxamide

Systemtic Name: N-[2-(4-methoxyphenyl)-3-oxidanylidene-3-[(phenylmethyl)amino]-1-thiophen-2-yl-propyl]pyrazine-2-carboxamide Openeye Name: N-[3-(benzylamino)-2-(4-methoxyphenyl)-3-oxo-1-(2-thienyl)propyl]pyrazine-2-carboxamide CAS Name: N-[2-(4-methoxyphenyl)-3-oxo-3-[(phenylmethyl)amino]-1-thiophen-2-ylpropyl]-2-pyrazinecarboxamide IUPAC Name: N-[3-(benzylamino)-2-(4-methoxyphenyl)-3-oxo-1-thiophen-2-ylpropyl]pyrazine-2-carboxamide Traditional Name: N-[3-(benzylamino)-3-keto-2-(4-methoxyphenyl)-1-(2-thienyl)propyl]pyrazinamide Formula: C26H24N4O3S MolecularWeight: 472.55876

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C(C2=CC=CS2)NC(=O)C3=NC=CN=C3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C(C(C2=CC=CS2)NC(=O)C3=NC=CN=C3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C26H24N4O3S/c1-33-20-11-9-19(10-12-20)23(26(32)29-16-18-6-3-2-4-7-18)24(22-8-5-15-34-22)30-25(31)21-17-27-13-14-28-21/h2-15,17,23-24H,16H2,1H3,(H,29,32)(H,30,31)