5-azanyl-3-(4-methoxyphenyl)-2-(4-methylphenyl)carbonyl-2,3-dihydrothiophene-4-carbonitrile

Systemtic Name: 5-azanyl-3-(4-methoxyphenyl)-2-(4-methylphenyl)carbonyl-2,3-dihydrothiophene-4-carbonitrile Openeye Name: 5-amino-3-(4-methoxyphenyl)-2-(4-methylbenzoyl)-2,3-dihydrothiophene-4-carbonitrile CAS Name: 5-amino-3-(4-methoxyphenyl)-2-[(4-methylphenyl)-oxomethyl]-2,3-dihydrothiophene-4-carbonitrile IUPAC Name: 5-amino-3-(4-methoxyphenyl)-2-(4-methylbenzoyl)-2,3-dihydrothiophene-4-carbonitrile Traditional Name: 5-amino-3-(4-methoxyphenyl)-2-p-toluoyl-2,3-dihydrothiophene-4-carbonitrile Formula: C20H18N2O2S MolecularWeight: 350.43412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2C(C(=C(S2)N)C#N)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2C(C(=C(S2)N)C#N)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H18N2O2S/c1-12-3-5-14(6-4-12)18(23)19-17(16(11-21)20(22)25-19)13-7-9-15(24-2)10-8-13/h3-10,17,19H,22H2,1-2H3