5-[4-(4-butyl-2-oxidanylidene-1,3-oxazolidin-3-yl)piperidin-1-yl]carbonyl-4-pyrrol-1-yl-thiophene-3-carbonitrile

Systemtic Name: 5-[4-(4-butyl-2-oxidanylidene-1,3-oxazolidin-3-yl)piperidin-1-yl]carbonyl-4-pyrrol-1-yl-thiophene-3-carbonitrile Openeye Name: 5-[4-(4-butyl-2-oxo-oxazolidin-3-yl)piperidine-1-carbonyl]-4-pyrrol-1-yl-thiophene-3-carbonitrile CAS Name: 5-[[4-(4-butyl-2-oxo-3-oxazolidinyl)-1-piperidinyl]-oxomethyl]-4-(1-pyrrolyl)-3-thiophenecarbonitrile IUPAC Name: 5-[4-(4-butyl-2-oxo-1,3-oxazolidin-3-yl)piperidine-1-carbonyl]-4-pyrrol-1-ylthiophene-3-carbonitrile Traditional Name: 5-[4-(4-butyl-2-keto-oxazolidin-3-yl)piperidine-1-carbonyl]-4-pyrrol-1-yl-thiophene-3-carbonitrile Formula: C22H26N4O3S MolecularWeight: 426.53184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1COC(=O)N1C2CCN(CC2)C(=O)C3=C(C(=CS3)C#N)N4C=CC=C4

Isomeric SMILES

CCCCC1COC(=O)N1C2CCN(CC2)C(=O)C3=C(C(=CS3)C#N)N4C=CC=C4

InChI

InChI=1S/C22H26N4O3S/c1-2-3-6-18-14-29-22(28)26(18)17-7-11-25(12-8-17)21(27)20-19(16(13-23)15-30-20)24-9-4-5-10-24/h4-5,9-10,15,17-18H,2-3,6-8,11-12,14H2,1H3