2-[(Z)-2,3-diphenyl-4-phenylsulfanyl-but-2-enyl]-4-methyl-1,4-benzothiazin-3-one

Systemtic Name: 2-[(Z)-2,3-diphenyl-4-phenylsulfanyl-but-2-enyl]-4-methyl-1,4-benzothiazin-3-one Openeye Name: 2-[(Z)-2,3-diphenyl-4-phenylsulfanyl-but-2-enyl]-4-methyl-1,4-benzothiazin-3-one CAS Name: 2-[(Z)-2,3-diphenyl-4-(phenylthio)but-2-enyl]-4-methyl-1,4-benzothiazin-3-one IUPAC Name: 2-[(Z)-2,3-diphenyl-4-phenylsulfanylbut-2-enyl]-4-methyl-1,4-benzothiazin-3-one Traditional Name: 2-[(Z)-2,3-diphenyl-4-(phenylthio)but-2-enyl]-4-methyl-1,4-benzothiazin-3-one Formula: C31H27NOS2 MolecularWeight: 493.68218

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2SC(C1=O)CC(=C(CSC3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CN1C2=CC=CC=C2SC(C1=O)C/C(=C(/CSC3=CC=CC=C3)\C4=CC=CC=C4)/C5=CC=CC=C5

InChI

InChI=1S/C31H27NOS2/c1-32-28-19-11-12-20-29(28)35-30(31(32)33)21-26(23-13-5-2-6-14-23)27(24-15-7-3-8-16-24)22-34-25-17-9-4-10-18-25/h2-20,30H,21-22H2,1H3/b27-26+