4-(3-bromanyl-4-methoxy-phenyl)-2-[1-(4-methylphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanyl-6-phenyl-pyridine-3-carbonitrile

Systemtic Name: 4-(3-bromanyl-4-methoxy-phenyl)-2-[1-(4-methylphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanyl-6-phenyl-pyridine-3-carbonitrile Openeye Name: 4-(3-bromo-4-methoxy-phenyl)-2-[2,5-dioxo-1-(p-tolyl)pyrrolidin-3-yl]sulfanyl-6-phenyl-pyridine-3-carbonitrile CAS Name: 4-(3-bromo-4-methoxyphenyl)-2-[[1-(4-methylphenyl)-2,5-dioxo-3-pyrrolidinyl]thio]-6-phenyl-3-pyridinecarbonitrile IUPAC Name: 4-(3-bromo-4-methoxyphenyl)-2-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl-6-phenylpyridine-3-carbonitrile Traditional Name: 4-(3-bromo-4-methoxy-phenyl)-2-[[2,5-diketo-1-(p-tolyl)pyrrolidin-3-yl]thio]-6-phenyl-nicotinonitrile Formula: C30H22BrN3O3S MolecularWeight: 584.48298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)CC(C2=O)SC3=C(C(=CC(=N3)C4=CC=CC=C4)C5=CC(=C(C=C5)OC)Br)C#N

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)CC(C2=O)SC3=C(C(=CC(=N3)C4=CC=CC=C4)C5=CC(=C(C=C5)OC)Br)C#N

InChI

InChI=1S/C30H22BrN3O3S/c1-18-8-11-21(12-9-18)34-28(35)16-27(30(34)36)38-29-23(17-32)22(20-10-13-26(37-2)24(31)14-20)15-25(33-29)19-6-4-3-5-7-19/h3-15,27H,16H2,1-2H3