(E)-N-(4-imidazol-1-ylbutyl)-3-(6-methylsulfinyl-4-oxidanylidene-quinazolin-3-yl)prop-2-enamide

Systemtic Name: (E)-N-(4-imidazol-1-ylbutyl)-3-(6-methylsulfinyl-4-oxidanylidene-quinazolin-3-yl)prop-2-enamide Openeye Name: (E)-N-(4-imidazol-1-ylbutyl)-3-(6-methylsulfinyl-4-oxo-quinazolin-3-yl)prop-2-enamide CAS Name: (E)-N-[4-(1-imidazolyl)butyl]-3-(6-methylsulfinyl-4-oxo-3-quinazolinyl)-2-propenamide IUPAC Name: (E)-N-(4-imidazol-1-ylbutyl)-3-(6-methylsulfinyl-4-oxoquinazolin-3-yl)prop-2-enamide Traditional Name: (E)-N-(4-imidazol-1-ylbutyl)-3-(4-keto-6-methylsulfinyl-quinazolin-3-yl)acrylamide Formula: C19H21N5O3S MolecularWeight: 399.46674

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)C1=CC2=C(C=C1)N=CN(C2=O)C=CC(=O)NCCCCN3C=CN=C3

Isomeric SMILES

CS(=O)C1=CC2=C(C=C1)N=CN(C2=O)/C=C/C(=O)NCCCCN3C=CN=C3

InChI

InChI=1S/C19H21N5O3S/c1-28(27)15-4-5-17-16(12-15)19(26)24(14-22-17)10-6-18(25)21-7-2-3-9-23-11-8-20-13-23/h4-6,8,10-14H,2-3,7,9H2,1H3,(H,21,25)/b10-6+