1-[4-[(2,4-dimethylphenyl)methyl]piperazin-1-yl]-3-phenyl-thiourea

Systemtic Name: 1-[4-[(2,4-dimethylphenyl)methyl]piperazin-1-yl]-3-phenyl-thiourea Openeye Name: 1-[4-[(2,4-dimethylphenyl)methyl]piperazin-1-yl]-3-phenyl-thiourea CAS Name: 1-[4-[(2,4-dimethylphenyl)methyl]-1-piperazinyl]-3-phenylthiourea IUPAC Name: 1-[4-[(2,4-dimethylphenyl)methyl]piperazin-1-yl]-3-phenylthiourea Traditional Name: 1-[4-(2,4-dimethylbenzyl)piperazino]-3-phenyl-thiourea Formula: C20H26N4S MolecularWeight: 354.51224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CN2CCN(CC2)NC(=S)NC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)CN2CCN(CC2)NC(=S)NC3=CC=CC=C3)C

InChI

InChI=1S/C20H26N4S/c1-16-8-9-18(17(2)14-16)15-23-10-12-24(13-11-23)22-20(25)21-19-6-4-3-5-7-19/h3-9,14H,10-13,15H2,1-2H3,(H2,21,22,25)