3-(4-butylphenyl)carbothioyl-5,6,7,8-tetrahydroindolizine-8-carbonitrile

Systemtic Name: 3-(4-butylphenyl)carbothioyl-5,6,7,8-tetrahydroindolizine-8-carbonitrile Openeye Name: 3-(4-butylbenzenecarbothioyl)-5,6,7,8-tetrahydroindolizine-8-carbonitrile CAS Name: 3-[(4-butylphenyl)-sulfanylidenemethyl]-5,6,7,8-tetrahydroindolizine-8-carbonitrile IUPAC Name: 3-(4-butylbenzenecarbothioyl)-5,6,7,8-tetrahydroindolizine-8-carbonitrile Traditional Name: 3-(4-butylthiobenzoyl)-5,6,7,8-tetrahydroindolizine-8-carbonitrile Formula: C20H22N2S MolecularWeight: 322.46708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=S)C2=CC=C3N2CCCC3C#N

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=S)C2=CC=C3N2CCCC3C#N

InChI

InChI=1S/C20H22N2S/c1-2-3-5-15-7-9-16(10-8-15)20(23)19-12-11-18-17(14-21)6-4-13-22(18)19/h7-12,17H,2-6,13H2,1H3