N-[(4-methoxyphenyl)-phenyl-methyl]-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-[(4-methoxyphenyl)-phenyl-methyl]-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: 2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[(4-methoxyphenyl)-phenyl-methyl]propanamide CAS Name: N-[(4-methoxyphenyl)-phenylmethyl]-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]propanamide IUPAC Name: N-[(4-methoxyphenyl)-phenylmethyl]-2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylpropanamide Traditional Name: 2-[(3-allyl-4-keto-quinazolin-2-yl)thio]-N-[(4-methoxyphenyl)-phenyl-methyl]propionamide Formula: C28H27N3O3S MolecularWeight: 485.59728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C1=CC=CC=C1)C2=CC=C(C=C2)OC)SC3=NC4=CC=CC=C4C(=O)N3CC=C

Isomeric SMILES

CC(C(=O)NC(C1=CC=CC=C1)C2=CC=C(C=C2)OC)SC3=NC4=CC=CC=C4C(=O)N3CC=C

InChI

InChI=1S/C28H27N3O3S/c1-4-18-31-27(33)23-12-8-9-13-24(23)29-28(31)35-19(2)26(32)30-25(20-10-6-5-7-11-20)21-14-16-22(34-3)17-15-21/h4-17,19,25H,1,18H2,2-3H3,(H,30,32)