(E)-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-3-(3-nitrophenyl)-N-(phenylmethyl)prop-2-enamide

Systemtic Name: (E)-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-3-(3-nitrophenyl)-N-(phenylmethyl)prop-2-enamide Openeye Name: (E)-N-benzyl-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-3-(3-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[4-(methylthio)-1,3-benzothiazol-2-yl]-3-(3-nitrophenyl)-N-(phenylmethyl)-2-propenamide IUPAC Name: (E)-N-benzyl-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-3-(3-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-benzyl-N-[4-(methylthio)-1,3-benzothiazol-2-yl]-3-(3-nitrophenyl)acrylamide Formula: C24H19N3O3S2 MolecularWeight: 461.55596

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC2=C1N=C(S2)N(CC3=CC=CC=C3)C(=O)C=CC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=CC2=C1N=C(S2)N(CC3=CC=CC=C3)C(=O)/C=C/C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H19N3O3S2/c1-31-20-11-6-12-21-23(20)25-24(32-21)26(16-18-7-3-2-4-8-18)22(28)14-13-17-9-5-10-19(15-17)27(29)30/h2-15H,16H2,1H3/b14-13+