N-(5-methylhexan-2-yl)-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-(5-methylhexan-2-yl)-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-allyl-N-(1,4-dimethylpentyl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-(5-methylhexan-2-yl)-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(5-methylhexan-2-yl)-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-allyl-N-(1,4-dimethylpentyl)-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C19H25N3O2S MolecularWeight: 359.4857

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)NC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CC=C

Isomeric SMILES

CC(C)CCC(C)NC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CC=C

InChI

InChI=1S/C19H25N3O2S/c1-5-10-22-18(24)15-9-8-14(11-16(15)21-19(22)25)17(23)20-13(4)7-6-12(2)3/h5,8-9,11-13H,1,6-7,10H2,2-4H3,(H,20,23)(H,21,25)