1-[[4-[[(2-ethyl-6-methyl-phenyl)carbamothioylamino]carbamoyl]phenyl]methyl]-3-propan-2-yl-urea

Systemtic Name: 1-[[4-[[(2-ethyl-6-methyl-phenyl)carbamothioylamino]carbamoyl]phenyl]methyl]-3-propan-2-yl-urea Openeye Name: 1-[[4-[[(2-ethyl-6-methyl-phenyl)carbamothioylamino]carbamoyl]phenyl]methyl]-3-isopropyl-urea CAS Name: 1-[[4-[[[(2-ethyl-6-methylanilino)-sulfanylidenemethyl]hydrazo]-oxomethyl]phenyl]methyl]-3-propan-2-ylurea IUPAC Name: 1-[[4-[[(2-ethyl-6-methylphenyl)carbamothioylamino]carbamoyl]phenyl]methyl]-3-propan-2-ylurea Traditional Name: 1-[4-[[(2-ethyl-6-methyl-phenyl)thiocarbamoylamino]carbamoyl]benzyl]-3-isopropyl-urea Formula: C22H29N5O2S MolecularWeight: 427.56296

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NNC(=O)C2=CC=C(C=C2)CNC(=O)NC(C)C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NNC(=O)C2=CC=C(C=C2)CNC(=O)NC(C)C)C

InChI

InChI=1S/C22H29N5O2S/c1-5-17-8-6-7-15(4)19(17)25-22(30)27-26-20(28)18-11-9-16(10-12-18)13-23-21(29)24-14(2)3/h6-12,14H,5,13H2,1-4H3,(H,26,28)(H2,23,24,29)(H2,25,27,30)