N-methyl-4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]benzamide

Systemtic Name: N-methyl-4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]benzamide Openeye Name: N-methyl-4-(4-methylthiazol-2-yl)sulfanyl-3-nitro-N-[(4-oxo-1H-quinazolin-2-yl)methyl]benzamide CAS Name: N-methyl-4-[(4-methyl-2-thiazolyl)thio]-3-nitro-N-[(4-oxo-1H-quinazolin-2-yl)methyl]benzamide IUPAC Name: N-methyl-4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-N-[(4-oxo-1H-quinazolin-2-yl)methyl]benzamide Traditional Name: N-[(4-keto-1H-quinazolin-2-yl)methyl]-N-methyl-4-[(4-methylthiazol-2-yl)thio]-3-nitro-benzamide Formula: C21H17N5O4S2 MolecularWeight: 467.52078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SC2=C(C=C(C=C2)C(=O)N(C)CC3=NC(=O)C4=CC=CC=C4N3)[N+](=O)[O-]

Isomeric SMILES

CC1=CSC(=N1)SC2=C(C=C(C=C2)C(=O)N(C)CC3=NC(=O)C4=CC=CC=C4N3)[N+](=O)[O-]

InChI

InChI=1S/C21H17N5O4S2/c1-12-11-31-21(22-12)32-17-8-7-13(9-16(17)26(29)30)20(28)25(2)10-18-23-15-6-4-3-5-14(15)19(27)24-18/h3-9,11H,10H2,1-2H3,(H,23,24,27)