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

Systemtic Name: N-[2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]-3-nitro-N-propan-2-yl-benzamide Openeye Name: N-[2-[(4,5-dimethylthiazol-2-yl)amino]-2-oxo-ethyl]-N-isopropyl-3-nitro-benzamide CAS Name: N-[2-[(4,5-dimethyl-2-thiazolyl)amino]-2-oxoethyl]-3-nitro-N-propan-2-ylbenzamide IUPAC Name: N-[2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]-3-nitro-N-propan-2-ylbenzamide Traditional Name: N-[2-[(4,5-dimethylthiazol-2-yl)amino]-2-keto-ethyl]-N-isopropyl-3-nitro-benzamide Formula: C17H20N4O4S MolecularWeight: 376.4301

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CN(C(C)C)C(=O)C2=CC(=CC=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CN(C(C)C)C(=O)C2=CC(=CC=C2)[N+](=O)[O-])C

InChI

InChI=1S/C17H20N4O4S/c1-10(2)20(9-15(22)19-17-18-11(3)12(4)26-17)16(23)13-6-5-7-14(8-13)21(24)25/h5-8,10H,9H2,1-4H3,(H,18,19,22)