1-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanoylamino]-3-phenyl-thiourea

Systemtic Name: 1-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethanoylamino]-3-phenyl-thiourea Openeye Name: 1-phenyl-3-[[2-[4-(p-tolylsulfonyl)piperazin-1-yl]acetyl]amino]thiourea CAS Name: 1-[[2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-1-oxoethyl]amino]-3-phenylthiourea IUPAC Name: 1-[[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]acetyl]amino]-3-phenylthiourea Traditional Name: 1-phenyl-3-[[2-(4-tosylpiperazino)acetyl]amino]thiourea Formula: C20H25N5O3S2 MolecularWeight: 447.5742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NNC(=S)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NNC(=S)NC3=CC=CC=C3

InChI

InChI=1S/C20H25N5O3S2/c1-16-7-9-18(10-8-16)30(27,28)25-13-11-24(12-14-25)15-19(26)22-23-20(29)21-17-5-3-2-4-6-17/h2-10H,11-15H2,1H3,(H,22,26)(H2,21,23,29)