1-[4-[4-(diphenylmethyl)piperazin-1-yl]sulfonylphenyl]-3-ethyl-thiourea

Systemtic Name: 1-[4-[4-(diphenylmethyl)piperazin-1-yl]sulfonylphenyl]-3-ethyl-thiourea Openeye Name: 1-[4-(4-benzhydrylpiperazin-1-yl)sulfonylphenyl]-3-ethyl-thiourea CAS Name: 1-[4-[[4-(diphenylmethyl)-1-piperazinyl]sulfonyl]phenyl]-3-ethylthiourea IUPAC Name: 1-[4-(4-benzhydrylpiperazin-1-yl)sulfonylphenyl]-3-ethylthiourea Traditional Name: 1-[4-(4-benzhydrylpiperazino)sulfonylphenyl]-3-ethyl-thiourea Formula: C26H30N4O2S2 MolecularWeight: 494.672

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCNC(=S)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H30N4O2S2/c1-2-27-26(33)28-23-13-15-24(16-14-23)34(31,32)30-19-17-29(18-20-30)25(21-9-5-3-6-10-21)22-11-7-4-8-12-22/h3-16,25H,2,17-20H2,1H3,(H2,27,28,33)