N-(4-butylphenyl)-4-(3-methoxyphenyl)piperazine-1-carbothioamide

Systemtic Name: N-(4-butylphenyl)-4-(3-methoxyphenyl)piperazine-1-carbothioamide Openeye Name: N-(4-butylphenyl)-4-(3-methoxyphenyl)piperazine-1-carbothioamide CAS Name: N-(4-butylphenyl)-4-(3-methoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: N-(4-butylphenyl)-4-(3-methoxyphenyl)piperazine-1-carbothioamide Traditional Name: N-(4-butylphenyl)-4-(3-methoxyphenyl)piperazine-1-carbothioamide Formula: C22H29N3OS MolecularWeight: 383.55016

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)N2CCN(CC2)C3=CC(=CC=C3)OC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)N2CCN(CC2)C3=CC(=CC=C3)OC

InChI

InChI=1S/C22H29N3OS/c1-3-4-6-18-9-11-19(12-10-18)23-22(27)25-15-13-24(14-16-25)20-7-5-8-21(17-20)26-2/h5,7-12,17H,3-4,6,13-16H2,1-2H3,(H,23,27)