5,5-dimethyl-2-[[(6-methyl-1,3-benzothiazol-2-yl)amino]methylidene]cyclohexane-1,3-dione

Systemtic Name: 5,5-dimethyl-2-[[(6-methyl-1,3-benzothiazol-2-yl)amino]methylidene]cyclohexane-1,3-dione Openeye Name: 5,5-dimethyl-2-[[(6-methyl-1,3-benzothiazol-2-yl)amino]methylene]cyclohexane-1,3-dione CAS Name: 5,5-dimethyl-2-[[(6-methyl-1,3-benzothiazol-2-yl)amino]methylidene]cyclohexane-1,3-dione IUPAC Name: 5,5-dimethyl-2-[[(6-methyl-1,3-benzothiazol-2-yl)amino]methylidene]cyclohexane-1,3-dione Traditional Name: 5,5-dimethyl-2-[[(6-methyl-1,3-benzothiazol-2-yl)amino]methylene]cyclohexane-1,3-quinone Formula: C17H18N2O2S MolecularWeight: 314.40202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC=C3C(=O)CC(CC3=O)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC=C3C(=O)CC(CC3=O)(C)C

InChI

InChI=1S/C17H18N2O2S/c1-10-4-5-12-15(6-10)22-16(19-12)18-9-11-13(20)7-17(2,3)8-14(11)21/h4-6,9H,7-8H2,1-3H3,(H,18,19)