N-[3-(1,3-benzothiazol-2-ylamino)-3-oxidanylidene-propyl]-4-nitro-benzamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-ylamino)-3-oxidanylidene-propyl]-4-nitro-benzamide Openeye Name: N-[3-(1,3-benzothiazol-2-ylamino)-3-oxo-propyl]-4-nitro-benzamide CAS Name: N-[3-(1,3-benzothiazol-2-ylamino)-3-oxopropyl]-4-nitrobenzamide IUPAC Name: N-[3-(1,3-benzothiazol-2-ylamino)-3-oxopropyl]-4-nitrobenzamide Traditional Name: N-[3-(1,3-benzothiazol-2-ylamino)-3-keto-propyl]-4-nitro-benzamide Formula: C17H14N4O4S MolecularWeight: 370.38246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NC(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)NC(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H14N4O4S/c22-15(20-17-19-13-3-1-2-4-14(13)26-17)9-10-18-16(23)11-5-7-12(8-6-11)21(24)25/h1-8H,9-10H2,(H,18,23)(H,19,20,22)