(E)-N-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]-4-(4-phenyl-2H-chromen-3-yl)but-3-enamide

Systemtic Name: (E)-N-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]-4-(4-phenyl-2H-chromen-3-yl)but-3-enamide Openeye Name: (E)-N-[6-methyl-2,4-bis(methylsulfanyl)-3-pyridyl]-4-(4-phenyl-2H-chromen-3-yl)but-3-enamide CAS Name: (E)-N-[6-methyl-2,4-bis(methylthio)-3-pyridinyl]-4-(4-phenyl-2H-1-benzopyran-3-yl)-3-butenamide IUPAC Name: (E)-N-[6-methyl-2,4-bis(methylsulfanyl)pyridin-3-yl]-4-(4-phenyl-2H-chromen-3-yl)but-3-enamide Traditional Name: (E)-N-[6-methyl-2,4-bis(methylthio)-3-pyridyl]-4-(4-phenyl-2H-chromen-3-yl)but-3-enamide Formula: C27H26N2O2S2 MolecularWeight: 474.63754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)SC)NC(=O)CC=CC2=C(C3=CC=CC=C3OC2)C4=CC=CC=C4)SC

Isomeric SMILES

CC1=NC(=C(C(=C1)SC)NC(=O)C/C=C/C2=C(C3=CC=CC=C3OC2)C4=CC=CC=C4)SC

InChI

InChI=1S/C27H26N2O2S2/c1-18-16-23(32-2)26(27(28-18)33-3)29-24(30)15-9-12-20-17-31-22-14-8-7-13-21(22)25(20)19-10-5-4-6-11-19/h4-14,16H,15,17H2,1-3H3,(H,29,30)/b12-9+