N-[2-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]ethyl]-3-methyl-4-nitro-benzamide

Systemtic Name: N-[2-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]ethyl]-3-methyl-4-nitro-benzamide Openeye Name: N-[2-[2-(4-chlorophenyl)thiazol-4-yl]ethyl]-3-methyl-4-nitro-benzamide CAS Name: N-[2-[2-(4-chlorophenyl)-4-thiazolyl]ethyl]-3-methyl-4-nitrobenzamide IUPAC Name: N-[2-[2-(4-chlorophenyl)-1,3-thiazol-4-yl]ethyl]-3-methyl-4-nitrobenzamide Traditional Name: N-[2-[2-(4-chlorophenyl)thiazol-4-yl]ethyl]-3-methyl-4-nitro-benzamide Formula: C19H16ClN3O3S MolecularWeight: 401.86664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCCC2=CSC(=N2)C3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCCC2=CSC(=N2)C3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H16ClN3O3S/c1-12-10-14(4-7-17(12)23(25)26)18(24)21-9-8-16-11-27-19(22-16)13-2-5-15(20)6-3-13/h2-7,10-11H,8-9H2,1H3,(H,21,24)