1-(2,3-dimethylcyclohexyl)-3-[4-[(4-methylphenyl)methyl]-3-oxidanylidene-1,4-benzothiazin-6-yl]urea

Systemtic Name: 1-(2,3-dimethylcyclohexyl)-3-[4-[(4-methylphenyl)methyl]-3-oxidanylidene-1,4-benzothiazin-6-yl]urea Openeye Name: 1-(2,3-dimethylcyclohexyl)-3-[3-oxo-4-(p-tolylmethyl)-1,4-benzothiazin-6-yl]urea CAS Name: 1-(2,3-dimethylcyclohexyl)-3-[4-[(4-methylphenyl)methyl]-3-oxo-1,4-benzothiazin-6-yl]urea IUPAC Name: 1-(2,3-dimethylcyclohexyl)-3-[4-[(4-methylphenyl)methyl]-3-oxo-1,4-benzothiazin-6-yl]urea Traditional Name: 1-(2,3-dimethylcyclohexyl)-3-[3-keto-4-(4-methylbenzyl)-1,4-benzothiazin-6-yl]urea Formula: C25H31N3O2S MolecularWeight: 437.59754

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)NC2=CC3=C(C=C2)SCC(=O)N3CC4=CC=C(C=C4)C

Isomeric SMILES

CC1CCCC(C1C)NC(=O)NC2=CC3=C(C=C2)SCC(=O)N3CC4=CC=C(C=C4)C

InChI

InChI=1S/C25H31N3O2S/c1-16-7-9-19(10-8-16)14-28-22-13-20(11-12-23(22)31-15-24(28)29)26-25(30)27-21-6-4-5-17(2)18(21)3/h7-13,17-18,21H,4-6,14-15H2,1-3H3,(H2,26,27,30)