N-(2-methoxyethyl)-4-oxidanylidene-N-(phenylmethyl)-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-(2-methoxyethyl)-4-oxidanylidene-N-(phenylmethyl)-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-allyl-N-benzyl-N-(2-methoxyethyl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-(2-methoxyethyl)-4-oxo-N-(phenylmethyl)-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-benzyl-N-(2-methoxyethyl)-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-allyl-N-benzyl-4-keto-N-(2-methoxyethyl)-2-thioxo-1H-quinazoline-7-carboxamide Formula: C22H23N3O3S MolecularWeight: 409.50132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=CC=CC=C1)C(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC=C

Isomeric SMILES

COCCN(CC1=CC=CC=C1)C(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC=C

InChI

InChI=1S/C22H23N3O3S/c1-3-11-25-21(27)18-10-9-17(14-19(18)23-22(25)29)20(26)24(12-13-28-2)15-16-7-5-4-6-8-16/h3-10,14H,1,11-13,15H2,2H3,(H,23,29)