N-[5-azanyl-4-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-oxidanylidene-2H-pyrrol-1-yl]-2-nitro-benzamide

Systemtic Name: N-[5-azanyl-4-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-oxidanylidene-2H-pyrrol-1-yl]-2-nitro-benzamide Openeye Name: N-[5-amino-4-[4-(4-bromophenyl)thiazol-2-yl]-3-oxo-2H-pyrrol-1-yl]-2-nitro-benzamide CAS Name: N-[5-amino-4-[4-(4-bromophenyl)-2-thiazolyl]-3-oxo-2H-pyrrol-1-yl]-2-nitrobenzamide IUPAC Name: N-[5-amino-4-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-oxo-2H-pyrrol-1-yl]-2-nitrobenzamide Traditional Name: N-[2-amino-3-[4-(4-bromophenyl)thiazol-2-yl]-4-keto-2-pyrrolin-1-yl]-2-nitro-benzamide Formula: C20H14BrN5O4S MolecularWeight: 500.32526

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C(=C(N1NC(=O)C2=CC=CC=C2[N+](=O)[O-])N)C3=NC(=CS3)C4=CC=C(C=C4)Br

Isomeric SMILES

C1C(=O)C(=C(N1NC(=O)C2=CC=CC=C2[N+](=O)[O-])N)C3=NC(=CS3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C20H14BrN5O4S/c21-12-7-5-11(6-8-12)14-10-31-20(23-14)17-16(27)9-25(18(17)22)24-19(28)13-3-1-2-4-15(13)26(29)30/h1-8,10H,9,22H2,(H,24,28)