2-azanyl-5-[[1-(2-methoxy-5-nitro-phenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]-1,3-thiazol-4-one

Systemtic Name: 2-azanyl-5-[[1-(2-methoxy-5-nitro-phenyl)-2,5-dimethyl-pyrrol-3-yl]methylidene]-1,3-thiazol-4-one Openeye Name: 2-amino-5-[[1-(2-methoxy-5-nitro-phenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]thiazol-4-one CAS Name: 2-amino-5-[[1-(2-methoxy-5-nitrophenyl)-2,5-dimethyl-3-pyrrolyl]methylidene]-4-thiazolone IUPAC Name: 2-amino-5-[[1-(2-methoxy-5-nitrophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1,3-thiazol-4-one Traditional Name: 2-amino-5-[[1-(2-methoxy-5-nitro-phenyl)-2,5-dimethyl-pyrrol-3-yl]methylene]-2-thiazolin-4-one Formula: C17H16N4O4S MolecularWeight: 372.39834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=C(C=CC(=C2)[N+](=O)[O-])OC)C)C=C3C(=O)N=C(S3)N

Isomeric SMILES

CC1=CC(=C(N1C2=C(C=CC(=C2)[N+](=O)[O-])OC)C)C=C3C(=O)N=C(S3)N

InChI

InChI=1S/C17H16N4O4S/c1-9-6-11(7-15-16(22)19-17(18)26-15)10(2)20(9)13-8-12(21(23)24)4-5-14(13)25-3/h4-8H,1-3H3,(H2,18,19,22)