N-(4-butan-2-ylphenyl)-4-(4-hydroxyphenyl)piperazine-1-carbothioamide

Systemtic Name: N-(4-butan-2-ylphenyl)-4-(4-hydroxyphenyl)piperazine-1-carbothioamide Openeye Name: 4-(4-hydroxyphenyl)-N-(4-sec-butylphenyl)piperazine-1-carbothioamide CAS Name: N-(4-butan-2-ylphenyl)-4-(4-hydroxyphenyl)-1-piperazinecarbothioamide IUPAC Name: N-(4-butan-2-ylphenyl)-4-(4-hydroxyphenyl)piperazine-1-carbothioamide Traditional Name: 4-(4-hydroxyphenyl)-N-(4-sec-butylphenyl)piperazine-1-carbothioamide Formula: C21H27N3OS MolecularWeight: 369.52358

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=S)N2CCN(CC2)C3=CC=C(C=C3)O

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=S)N2CCN(CC2)C3=CC=C(C=C3)O

InChI

InChI=1S/C21H27N3OS/c1-3-16(2)17-4-6-18(7-5-17)22-21(26)24-14-12-23(13-15-24)19-8-10-20(25)11-9-19/h4-11,16,25H,3,12-15H2,1-2H3,(H,22,26)