[2-(2-methylphenyl)imino-1,3-thiazinan-3-yl]-(4-morpholin-4-yl-3-nitro-phenyl)methanone

Systemtic Name: [2-(2-methylphenyl)imino-1,3-thiazinan-3-yl]-(4-morpholin-4-yl-3-nitro-phenyl)methanone Openeye Name: (4-morpholino-3-nitro-phenyl)-[2-(o-tolylimino)-1,3-thiazinan-3-yl]methanone CAS Name: [2-(2-methylphenyl)imino-1,3-thiazinan-3-yl]-[4-(4-morpholinyl)-3-nitrophenyl]methanone IUPAC Name: [2-(2-methylphenyl)imino-1,3-thiazinan-3-yl]-(4-morpholin-4-yl-3-nitrophenyl)methanone Traditional Name: (4-morpholino-3-nitro-phenyl)-[2-(o-tolylimino)-1,3-thiazinan-3-yl]methanone Formula: C22H24N4O4S MolecularWeight: 440.51536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N=C2N(CCCS2)C(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1N=C2N(CCCS2)C(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O4S/c1-16-5-2-3-6-18(16)23-22-25(9-4-14-31-22)21(27)17-7-8-19(20(15-17)26(28)29)24-10-12-30-13-11-24/h2-3,5-8,15H,4,9-14H2,1H3