N-[2-[7-chloranyl-3-(3-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]-1-methyl-pyrrole-2-carboxamide

Systemtic Name: N-[2-[7-chloranyl-3-(3-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]-1-methyl-pyrrole-2-carboxamide Openeye Name: N-[2-[7-chloro-3-(m-tolyl)-4-oxo-quinazolin-2-yl]sulfanylacetyl]-1-methyl-pyrrole-2-carboxamide CAS Name: N-[2-[[7-chloro-3-(3-methylphenyl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: N-[2-[7-chloro-3-(3-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylacetyl]-1-methylpyrrole-2-carboxamide Traditional Name: N-[2-[[7-chloro-4-keto-3-(m-tolyl)quinazolin-2-yl]thio]acetyl]-1-methyl-pyrrole-2-carboxamide Formula: C23H19ClN4O3S MolecularWeight: 466.93996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)NC(=O)C4=CC=CN4C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)NC(=O)C4=CC=CN4C

InChI

InChI=1S/C23H19ClN4O3S/c1-14-5-3-6-16(11-14)28-22(31)17-9-8-15(24)12-18(17)25-23(28)32-13-20(29)26-21(30)19-7-4-10-27(19)2/h3-12H,13H2,1-2H3,(H,26,29,30)