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

Systemtic Name: N-[4-(2-azanyl-2-oxidanylidene-ethyl)-1,3-thiazol-2-yl]-4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-benzamide Openeye Name: N-[4-(2-amino-2-oxo-ethyl)thiazol-2-yl]-4-(4-methylthiazol-2-yl)sulfanyl-3-nitro-benzamide CAS Name: N-[4-(2-amino-2-oxoethyl)-2-thiazolyl]-4-[(4-methyl-2-thiazolyl)thio]-3-nitrobenzamide IUPAC Name: N-[4-(2-amino-2-oxoethyl)-1,3-thiazol-2-yl]-4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitrobenzamide Traditional Name: N-[4-(2-amino-2-keto-ethyl)thiazol-2-yl]-4-[(4-methylthiazol-2-yl)thio]-3-nitro-benzamide Formula: C16H13N5O4S3 MolecularWeight: 435.50052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SC2=C(C=C(C=C2)C(=O)NC3=NC(=CS3)CC(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC1=CSC(=N1)SC2=C(C=C(C=C2)C(=O)NC3=NC(=CS3)CC(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C16H13N5O4S3/c1-8-6-27-16(18-8)28-12-3-2-9(4-11(12)21(24)25)14(23)20-15-19-10(7-26-15)5-13(17)22/h2-4,6-7H,5H2,1H3,(H2,17,22)(H,19,20,23)