N-[3-[(2-methyl-1,3-benzothiazol-6-yl)amino]-3-oxidanylidene-propyl]-4-nitro-benzamide

Systemtic Name: N-[3-[(2-methyl-1,3-benzothiazol-6-yl)amino]-3-oxidanylidene-propyl]-4-nitro-benzamide Openeye Name: N-[3-[(2-methyl-1,3-benzothiazol-6-yl)amino]-3-oxo-propyl]-4-nitro-benzamide CAS Name: N-[3-[(2-methyl-1,3-benzothiazol-6-yl)amino]-3-oxopropyl]-4-nitrobenzamide IUPAC Name: N-[3-[(2-methyl-1,3-benzothiazol-6-yl)amino]-3-oxopropyl]-4-nitrobenzamide Traditional Name: N-[3-keto-3-[(2-methyl-1,3-benzothiazol-6-yl)amino]propyl]-4-nitro-benzamide Formula: C18H16N4O4S MolecularWeight: 384.40904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NC(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)NC(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H16N4O4S/c1-11-20-15-7-4-13(10-16(15)27-11)21-17(23)8-9-19-18(24)12-2-5-14(6-3-12)22(25)26/h2-7,10H,8-9H2,1H3,(H,19,24)(H,21,23)