2-(1,3-benzothiazol-2-ylsulfanyl)-3-[3-methoxy-4-[(4-nitrophenyl)methoxy]phenyl]prop-2-enenitrile

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-[3-methoxy-4-[(4-nitrophenyl)methoxy]phenyl]prop-2-enenitrile Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-[3-methoxy-4-[(4-nitrophenyl)methoxy]phenyl]prop-2-enenitrile CAS Name: 2-(1,3-benzothiazol-2-ylthio)-3-[3-methoxy-4-[(4-nitrophenyl)methoxy]phenyl]-2-propenenitrile IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-[3-methoxy-4-[(4-nitrophenyl)methoxy]phenyl]prop-2-enenitrile Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-3-[3-methoxy-4-(4-nitrobenzyl)oxy-phenyl]acrylonitrile Formula: C24H17N3O4S2 MolecularWeight: 475.53948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)SC2=NC3=CC=CC=C3S2)OCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)C=C(C#N)SC2=NC3=CC=CC=C3S2)OCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H17N3O4S2/c1-30-22-13-17(8-11-21(22)31-15-16-6-9-18(10-7-16)27(28)29)12-19(14-25)32-24-26-20-4-2-3-5-23(20)33-24/h2-13H,15H2,1H3