2-methyl-N-[1-[(4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazolin-7-yl)carbonyl]piperidin-4-yl]benzamide

Systemtic Name: 2-methyl-N-[1-[(4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazolin-7-yl)carbonyl]piperidin-4-yl]benzamide Openeye Name: N-[1-(3-allyl-4-oxo-2-thioxo-1H-quinazoline-7-carbonyl)-4-piperidyl]-2-methyl-benzamide CAS Name: 2-methyl-N-[1-[oxo-(4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazolin-7-yl)methyl]-4-piperidinyl]benzamide IUPAC Name: 2-methyl-N-[1-(4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carbonyl)piperidin-4-yl]benzamide Traditional Name: N-[1-(3-allyl-4-keto-2-thioxo-1H-quinazoline-7-carbonyl)-4-piperidyl]-2-methyl-benzamide Formula: C25H26N4O3S MolecularWeight: 462.56394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2CCN(CC2)C(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)CC=C

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2CCN(CC2)C(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)CC=C

InChI

InChI=1S/C25H26N4O3S/c1-3-12-29-24(32)20-9-8-17(15-21(20)27-25(29)33)23(31)28-13-10-18(11-14-28)26-22(30)19-7-5-4-6-16(19)2/h3-9,15,18H,1,10-14H2,2H3,(H,26,30)(H,27,33)