1-[[4-[[2-(4-methylphenyl)sulfanylethanoylamino]carbamoyl]phenyl]methyl]-3-propan-2-yl-urea

Systemtic Name: 1-[[4-[[2-(4-methylphenyl)sulfanylethanoylamino]carbamoyl]phenyl]methyl]-3-propan-2-yl-urea Openeye Name: 1-isopropyl-3-[[4-[[[2-(p-tolylsulfanyl)acetyl]amino]carbamoyl]phenyl]methyl]urea CAS Name: 1-[[4-[[[2-[(4-methylphenyl)thio]-1-oxoethyl]hydrazo]-oxomethyl]phenyl]methyl]-3-propan-2-ylurea IUPAC Name: 1-[[4-[[[2-(4-methylphenyl)sulfanylacetyl]amino]carbamoyl]phenyl]methyl]-3-propan-2-ylurea Traditional Name: 1-isopropyl-3-[4-[[[2-(p-tolylthio)acetyl]amino]carbamoyl]benzyl]urea Formula: C21H26N4O3S MolecularWeight: 414.52114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)NNC(=O)C2=CC=C(C=C2)CNC(=O)NC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)NNC(=O)C2=CC=C(C=C2)CNC(=O)NC(C)C

InChI

InChI=1S/C21H26N4O3S/c1-14(2)23-21(28)22-12-16-6-8-17(9-7-16)20(27)25-24-19(26)13-29-18-10-4-15(3)5-11-18/h4-11,14H,12-13H2,1-3H3,(H,24,26)(H,25,27)(H2,22,23,28)