N-[4-(2-azanyl-2-oxidanylidene-ethyl)phenyl]-N-(4-chloranyl-3-methyl-1,2-thiazol-5-yl)-3-nitro-propanamide

Systemtic Name: N-[4-(2-azanyl-2-oxidanylidene-ethyl)phenyl]-N-(4-chloranyl-3-methyl-1,2-thiazol-5-yl)-3-nitro-propanamide Openeye Name: N-[4-(2-amino-2-oxo-ethyl)phenyl]-N-(4-chloro-3-methyl-isothiazol-5-yl)-3-nitro-propanamide CAS Name: N-[4-(2-amino-2-oxoethyl)phenyl]-N-(4-chloro-3-methyl-5-isothiazolyl)-3-nitropropanamide IUPAC Name: N-[4-(2-amino-2-oxoethyl)phenyl]-N-(4-chloro-3-methyl-1,2-thiazol-5-yl)-3-nitropropanamide Traditional Name: N-[4-(2-amino-2-keto-ethyl)phenyl]-N-(4-chloro-3-methyl-isothiazol-5-yl)-3-nitro-propionamide Formula: C15H15ClN4O4S MolecularWeight: 382.822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=C1Cl)N(C2=CC=C(C=C2)CC(=O)N)C(=O)CC[N+](=O)[O-]

Isomeric SMILES

CC1=NSC(=C1Cl)N(C2=CC=C(C=C2)CC(=O)N)C(=O)CC[N+](=O)[O-]

InChI

InChI=1S/C15H15ClN4O4S/c1-9-14(16)15(25-18-9)20(13(22)6-7-19(23)24)11-4-2-10(3-5-11)8-12(17)21/h2-5H,6-8H2,1H3,(H2,17,21)