2-[2-[methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]-2-oxidanylidene-ethyl]sulfanyl-N-(3-methylphenyl)ethanamide

Systemtic Name: 2-[2-[methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]-2-oxidanylidene-ethyl]sulfanyl-N-(3-methylphenyl)ethanamide Openeye Name: 2-[2-[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]-2-oxo-ethyl]sulfanyl-N-(m-tolyl)acetamide CAS Name: 2-[[2-[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]-2-oxoethyl]thio]-N-(3-methylphenyl)acetamide IUPAC Name: 2-[2-[methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]-2-oxoethyl]sulfanyl-N-(3-methylphenyl)acetamide Traditional Name: 2-[[2-keto-2-[(4-keto-1H-quinazolin-2-yl)methyl-methyl-amino]ethyl]thio]-N-(m-tolyl)acetamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSCC(=O)N(C)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSCC(=O)N(C)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C21H22N4O3S/c1-14-6-5-7-15(10-14)22-19(26)12-29-13-20(27)25(2)11-18-23-17-9-4-3-8-16(17)21(28)24-18/h3-10H,11-13H2,1-2H3,(H,22,26)(H,23,24,28)