N-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-2-methyl-5-methylsulfonyl-N-propyl-benzamide

Systemtic Name: N-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-2-methyl-5-methylsulfonyl-N-propyl-benzamide Openeye Name: N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-2-methyl-5-methylsulfonyl-N-propyl-benzamide CAS Name: N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-2-methyl-5-methylsulfonyl-N-propylbenzamide IUPAC Name: N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-2-methyl-5-methylsulfonyl-N-propylbenzamide Traditional Name: N-[(7-chloro-4-keto-1H-quinazolin-2-yl)methyl]-5-mesyl-2-methyl-N-propyl-benzamide Formula: C21H22ClN3O4S MolecularWeight: 447.93508

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)C(=O)C3=C(C=CC(=C3)S(=O)(=O)C)C

Isomeric SMILES

CCCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)C(=O)C3=C(C=CC(=C3)S(=O)(=O)C)C

InChI

InChI=1S/C21H22ClN3O4S/c1-4-9-25(21(27)17-11-15(30(3,28)29)7-5-13(17)2)12-19-23-18-10-14(22)6-8-16(18)20(26)24-19/h5-8,10-11H,4,9,12H2,1-3H3,(H,23,24,26)