2-[1-(4-methoxyphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanyl-6-propyl-pyridine-3-carbonitrile

Systemtic Name: 2-[1-(4-methoxyphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanyl-6-propyl-pyridine-3-carbonitrile Openeye Name: 2-[1-(4-methoxyphenyl)-2,5-dioxo-pyrrolidin-3-yl]sulfanyl-6-propyl-pyridine-3-carbonitrile CAS Name: 2-[[1-(4-methoxyphenyl)-2,5-dioxo-3-pyrrolidinyl]thio]-6-propyl-3-pyridinecarbonitrile IUPAC Name: 2-[1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl-6-propylpyridine-3-carbonitrile Traditional Name: 2-[[2,5-diketo-1-(4-methoxyphenyl)pyrrolidin-3-yl]thio]-6-propyl-nicotinonitrile Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=C(C=C1)C#N)SC2CC(=O)N(C2=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCC1=NC(=C(C=C1)C#N)SC2CC(=O)N(C2=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H19N3O3S/c1-3-4-14-6-5-13(12-21)19(22-14)27-17-11-18(24)23(20(17)25)15-7-9-16(26-2)10-8-15/h5-10,17H,3-4,11H2,1-2H3