N-methyl-1-(3-methylsulfanylphenyl)-5-oxidanylidene-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]pyrrolidine-3-carboxamide

Systemtic Name: N-methyl-1-(3-methylsulfanylphenyl)-5-oxidanylidene-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]pyrrolidine-3-carboxamide Openeye Name: N-methyl-1-(3-methylsulfanylphenyl)-5-oxo-N-[(4-oxo-1H-quinazolin-2-yl)methyl]pyrrolidine-3-carboxamide CAS Name: N-methyl-1-[3-(methylthio)phenyl]-5-oxo-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-3-pyrrolidinecarboxamide IUPAC Name: N-methyl-1-(3-methylsulfanylphenyl)-5-oxo-N-[(4-oxo-1H-quinazolin-2-yl)methyl]pyrrolidine-3-carboxamide Traditional Name: 5-keto-N-[(4-keto-1H-quinazolin-2-yl)methyl]-N-methyl-1-[3-(methylthio)phenyl]pyrrolidine-3-carboxamide Formula: C22H22N4O3S MolecularWeight: 422.50008

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3CC(=O)N(C3)C4=CC(=CC=C4)SC

Isomeric SMILES

CN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3CC(=O)N(C3)C4=CC(=CC=C4)SC

InChI

InChI=1S/C22H22N4O3S/c1-25(13-19-23-18-9-4-3-8-17(18)21(28)24-19)22(29)14-10-20(27)26(12-14)15-6-5-7-16(11-15)30-2/h3-9,11,14H,10,12-13H2,1-2H3,(H,23,24,28)