4-chloranyl-N-(cyclohexylmethyl)-N-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)NC(=O)CN(CC2CCCCC2)C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CSC(=N1)NC(=O)CN(CC2CCCCC2)C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H23ClN4O4S/c1-13-12-30-20(22-13)23-18(26)11-24(10-14-5-3-2-4-6-14)19(27)15-7-8-16(21)17(9-15)25(28)29/h7-9,12,14H,2-6,10-11H2,1H3,(H,22,23,26)