4-[(3-methoxyphenyl)methyl]-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]piperazine-1-carbothioamide

Systemtic Name: 4-[(3-methoxyphenyl)methyl]-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]piperazine-1-carbothioamide Openeye Name: 4-[(3-methoxyphenyl)methyl]-N-[1-(o-tolylmethyl)pyrazol-4-yl]piperazine-1-carbothioamide CAS Name: 4-[(3-methoxyphenyl)methyl]-N-[1-[(2-methylphenyl)methyl]-4-pyrazolyl]-1-piperazinecarbothioamide IUPAC Name: 4-[(3-methoxyphenyl)methyl]-N-[1-[(2-methylphenyl)methyl]pyrazol-4-yl]piperazine-1-carbothioamide Traditional Name: 4-m-anisyl-N-[1-(2-methylbenzyl)pyrazol-4-yl]piperazine-1-carbothioamide Formula: C24H29N5OS MolecularWeight: 435.58496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=C(C=N2)NC(=S)N3CCN(CC3)CC4=CC(=CC=C4)OC

Isomeric SMILES

CC1=CC=CC=C1CN2C=C(C=N2)NC(=S)N3CCN(CC3)CC4=CC(=CC=C4)OC

InChI

InChI=1S/C24H29N5OS/c1-19-6-3-4-8-21(19)17-29-18-22(15-25-29)26-24(31)28-12-10-27(11-13-28)16-20-7-5-9-23(14-20)30-2/h3-9,14-15,18H,10-13,16-17H2,1-2H3,(H,26,31)