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

Systemtic Name: N-cyclohexyl-N-[2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-cyclohexyl-N-[2-[(4,5-dimethylthiazol-2-yl)amino]-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-cyclohexyl-N-[2-[(4,5-dimethyl-2-thiazolyl)amino]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-cyclohexyl-N-[2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]-3-nitrobenzamide Traditional Name: N-cyclohexyl-N-[2-[(4,5-dimethylthiazol-2-yl)amino]-2-keto-ethyl]-3-nitro-benzamide Formula: C20H24N4O4S MolecularWeight: 416.49396

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24N4O4S/c1-13-14(2)29-20(21-13)22-18(25)12-23(16-8-4-3-5-9-16)19(26)15-7-6-10-17(11-15)24(27)28/h6-7,10-11,16H,3-5,8-9,12H2,1-2H3,(H,21,22,25)