3-(3-nitrophenyl)-1-(2-prop-2-enylsulfanylbenzimidazol-1-yl)prop-2-en-1-one

Systemtic Name: 3-(3-nitrophenyl)-1-(2-prop-2-enylsulfanylbenzimidazol-1-yl)prop-2-en-1-one Openeye Name: 1-(2-allylsulfanylbenzimidazol-1-yl)-3-(3-nitrophenyl)prop-2-en-1-one CAS Name: 3-(3-nitrophenyl)-1-[2-(prop-2-enylthio)-1-benzimidazolyl]-2-propen-1-one IUPAC Name: 3-(3-nitrophenyl)-1-(2-prop-2-enylsulfanylbenzimidazol-1-yl)prop-2-en-1-one Traditional Name: 1-[2-(allylthio)benzimidazol-1-yl]-3-(3-nitrophenyl)prop-2-en-1-one Formula: C19H15N3O3S MolecularWeight: 365.4057

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NC2=CC=CC=C2N1C(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C=CCSC1=NC2=CC=CC=C2N1C(=O)C=CC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H15N3O3S/c1-2-12-26-19-20-16-8-3-4-9-17(16)21(19)18(23)11-10-14-6-5-7-15(13-14)22(24)25/h2-11,13H,1,12H2