N-(4-butan-2-ylphenyl)-4-(3-hydroxyphenyl)piperazine-1-carbothioamide

Systemtic Name: N-(4-butan-2-ylphenyl)-4-(3-hydroxyphenyl)piperazine-1-carbothioamide Openeye Name: 4-(3-hydroxyphenyl)-N-(4-sec-butylphenyl)piperazine-1-carbothioamide CAS Name: N-(4-butan-2-ylphenyl)-4-(3-hydroxyphenyl)-1-piperazinecarbothioamide IUPAC Name: N-(4-butan-2-ylphenyl)-4-(3-hydroxyphenyl)piperazine-1-carbothioamide Traditional Name: 4-(3-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(=CC=C3)O

Isomeric SMILES

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

InChI

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