N-(4-butan-2-ylphenyl)-4-(naphthalen-1-ylmethyl)piperazine-1-carbothioamide

Systemtic Name: N-(4-butan-2-ylphenyl)-4-(naphthalen-1-ylmethyl)piperazine-1-carbothioamide Openeye Name: 4-(1-naphthylmethyl)-N-(4-sec-butylphenyl)piperazine-1-carbothioamide CAS Name: N-(4-butan-2-ylphenyl)-4-(1-naphthalenylmethyl)-1-piperazinecarbothioamide IUPAC Name: N-(4-butan-2-ylphenyl)-4-(naphthalen-1-ylmethyl)piperazine-1-carbothioamide Traditional Name: 4-(1-naphthylmethyl)-N-(4-sec-butylphenyl)piperazine-1-carbothioamide Formula: C26H31N3S MolecularWeight: 417.60944

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=S)N2CCN(CC2)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=S)N2CCN(CC2)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C26H31N3S/c1-3-20(2)21-11-13-24(14-12-21)27-26(30)29-17-15-28(16-18-29)19-23-9-6-8-22-7-4-5-10-25(22)23/h4-14,20H,3,15-19H2,1-2H3,(H,27,30)