5,5-dimethyl-2-[[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]amino]methylidene]cyclohexane-1,3-dione

Systemtic Name: 5,5-dimethyl-2-[[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]amino]methylidene]cyclohexane-1,3-dione Openeye Name: 5,5-dimethyl-2-[[[4-(3-nitrophenyl)thiazol-2-yl]amino]methylene]cyclohexane-1,3-dione CAS Name: 5,5-dimethyl-2-[[[4-(3-nitrophenyl)-2-thiazolyl]amino]methylidene]cyclohexane-1,3-dione IUPAC Name: 5,5-dimethyl-2-[[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]amino]methylidene]cyclohexane-1,3-dione Traditional Name: 5,5-dimethyl-2-[[[4-(3-nitrophenyl)thiazol-2-yl]amino]methylene]cyclohexane-1,3-quinone Formula: C18H17N3O4S MolecularWeight: 371.41028

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(=CNC2=NC(=CS2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)C1)C

Isomeric SMILES

CC1(CC(=O)C(=CNC2=NC(=CS2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)C1)C

InChI

InChI=1S/C18H17N3O4S/c1-18(2)7-15(22)13(16(23)8-18)9-19-17-20-14(10-26-17)11-4-3-5-12(6-11)21(24)25/h3-6,9-10H,7-8H2,1-2H3,(H,19,20)