1-(2-methoxyphenyl)-3-[2-[4-[(4-methylphenyl)carbamothioyl]piperazin-1-yl]ethyl]urea

Systemtic Name: 1-(2-methoxyphenyl)-3-[2-[4-[(4-methylphenyl)carbamothioyl]piperazin-1-yl]ethyl]urea Openeye Name: 1-(2-methoxyphenyl)-3-[2-[4-(p-tolylcarbamothioyl)piperazin-1-yl]ethyl]urea CAS Name: 1-(2-methoxyphenyl)-3-[2-[4-[(4-methylanilino)-sulfanylidenemethyl]-1-piperazinyl]ethyl]urea IUPAC Name: 1-(2-methoxyphenyl)-3-[2-[4-[(4-methylphenyl)carbamothioyl]piperazin-1-yl]ethyl]urea Traditional Name: 1-(2-methoxyphenyl)-3-[2-[4-(p-tolylthiocarbamoyl)piperazino]ethyl]urea Formula: C22H29N5O2S MolecularWeight: 427.56296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)N2CCN(CC2)CCNC(=O)NC3=CC=CC=C3OC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)N2CCN(CC2)CCNC(=O)NC3=CC=CC=C3OC

InChI

InChI=1S/C22H29N5O2S/c1-17-7-9-18(10-8-17)24-22(30)27-15-13-26(14-16-27)12-11-23-21(28)25-19-5-3-4-6-20(19)29-2/h3-10H,11-16H2,1-2H3,(H,24,30)(H2,23,25,28)