4-[(4-tert-butylphenyl)methyl]-N-(2,6-diethylphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-[(4-tert-butylphenyl)methyl]-N-(2,6-diethylphenyl)piperazine-1-carbothioamide Openeye Name: 4-[(4-tert-butylphenyl)methyl]-N-(2,6-diethylphenyl)piperazine-1-carbothioamide CAS Name: 4-[(4-tert-butylphenyl)methyl]-N-(2,6-diethylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-[(4-tert-butylphenyl)methyl]-N-(2,6-diethylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(4-tert-butylbenzyl)-N-(2,6-diethylphenyl)piperazine-1-carbothioamide Formula: C26H37N3S MolecularWeight: 423.65708

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=S)N2CCN(CC2)CC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=S)N2CCN(CC2)CC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C26H37N3S/c1-6-21-9-8-10-22(7-2)24(21)27-25(30)29-17-15-28(16-18-29)19-20-11-13-23(14-12-20)26(3,4)5/h8-14H,6-7,15-19H2,1-5H3,(H,27,30)