2-chloranyl-N-cyclohexyl-N-[2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-cyclohexyl-N-[2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]-4-nitro-benzamide Openeye Name: 2-chloro-N-cyclohexyl-N-[2-[(4,5-dimethylthiazol-2-yl)amino]-2-oxo-ethyl]-4-nitro-benzamide CAS Name: 2-chloro-N-cyclohexyl-N-[2-[(4,5-dimethyl-2-thiazolyl)amino]-2-oxoethyl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-cyclohexyl-N-[2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]-4-nitrobenzamide Traditional Name: 2-chloro-N-cyclohexyl-N-[2-[(4,5-dimethylthiazol-2-yl)amino]-2-keto-ethyl]-4-nitro-benzamide Formula: C20H23ClN4O4S MolecularWeight: 450.93902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CN(C2CCCCC2)C(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl)C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CN(C2CCCCC2)C(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C20H23ClN4O4S/c1-12-13(2)30-20(22-12)23-18(26)11-24(14-6-4-3-5-7-14)19(27)16-9-8-15(25(28)29)10-17(16)21/h8-10,14H,3-7,11H2,1-2H3,(H,22,23,26)