1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-quinazolin-4-ylsulfanyl-propan-1-one

Systemtic Name: 1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-quinazolin-4-ylsulfanyl-propan-1-one Openeye Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-quinazolin-4-ylsulfanyl-propan-1-one CAS Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-(4-quinazolinylthio)-1-propanone IUPAC Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-quinazolin-4-ylsulfanylpropan-1-one Traditional Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-(quinazolin-4-ylthio)propan-1-one Formula: C19H19N3O2S MolecularWeight: 353.43806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)C(C)SC2=NC=NC3=CC=CC=C32

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)C(C)SC2=NC=NC3=CC=CC=C32

InChI

InChI=1S/C19H19N3O2S/c1-10-16(12(3)23)11(2)22-17(10)18(24)13(4)25-19-14-7-5-6-8-15(14)20-9-21-19/h5-9,13,22H,1-4H3