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

Systemtic Name: N-[2-[3-(4-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]-1-methyl-pyrrole-2-carboxamide Openeye Name: N-[2-[3-(4-chlorophenyl)-4-oxo-quinazolin-2-yl]sulfanylacetyl]-1-methyl-pyrrole-2-carboxamide CAS Name: N-[2-[[3-(4-chlorophenyl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: N-[2-[3-(4-chlorophenyl)-4-oxoquinazolin-2-yl]sulfanylacetyl]-1-methylpyrrole-2-carboxamide Traditional Name: N-[2-[[3-(4-chlorophenyl)-4-keto-quinazolin-2-yl]thio]acetyl]-1-methyl-pyrrole-2-carboxamide Formula: C22H17ClN4O3S MolecularWeight: 452.91338

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=O)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)Cl

Isomeric SMILES

CN1C=CC=C1C(=O)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H17ClN4O3S/c1-26-12-4-7-18(26)20(29)25-19(28)13-31-22-24-17-6-3-2-5-16(17)21(30)27(22)15-10-8-14(23)9-11-15/h2-12H,13H2,1H3,(H,25,28,29)