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

Systemtic Name: N-[3-[(4-methyl-1,3-thiazol-2-yl)-phenyl-amino]-3-oxidanylidene-propyl]-4-nitro-benzamide Openeye Name: N-[3-(N-(4-methylthiazol-2-yl)anilino)-3-oxo-propyl]-4-nitro-benzamide CAS Name: N-[3-(N-(4-methyl-2-thiazolyl)anilino)-3-oxopropyl]-4-nitrobenzamide IUPAC Name: N-[3-(N-(4-methyl-1,3-thiazol-2-yl)anilino)-3-oxopropyl]-4-nitrobenzamide Traditional Name: N-[3-keto-3-(N-(4-methylthiazol-2-yl)anilino)propyl]-4-nitro-benzamide Formula: C20H18N4O4S MolecularWeight: 410.44632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)N(C2=CC=CC=C2)C(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CSC(=N1)N(C2=CC=CC=C2)C(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O4S/c1-14-13-29-20(22-14)23(16-5-3-2-4-6-16)18(25)11-12-21-19(26)15-7-9-17(10-8-15)24(27)28/h2-10,13H,11-12H2,1H3,(H,21,26)