1-[(1-methylindol-3-yl)carbonylamino]-3-[2-[(4-methylphenyl)methylsulfanyl]ethyl]urea

Systemtic Name: 1-[(1-methylindol-3-yl)carbonylamino]-3-[2-[(4-methylphenyl)methylsulfanyl]ethyl]urea Openeye Name: 1-[(1-methylindole-3-carbonyl)amino]-3-[2-(p-tolylmethylsulfanyl)ethyl]urea CAS Name: 1-[[(1-methyl-3-indolyl)-oxomethyl]amino]-3-[2-[(4-methylphenyl)methylthio]ethyl]urea IUPAC Name: 1-[(1-methylindole-3-carbonyl)amino]-3-[2-[(4-methylphenyl)methylsulfanyl]ethyl]urea Traditional Name: 1-[2-[(4-methylbenzyl)thio]ethyl]-3-[(1-methylindole-3-carbonyl)amino]urea Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCCNC(=O)NNC(=O)C2=CN(C3=CC=CC=C32)C

Isomeric SMILES

CC1=CC=C(C=C1)CSCCNC(=O)NNC(=O)C2=CN(C3=CC=CC=C32)C

InChI

InChI=1S/C21H24N4O2S/c1-15-7-9-16(10-8-15)14-28-12-11-22-21(27)24-23-20(26)18-13-25(2)19-6-4-3-5-17(18)19/h3-10,13H,11-12,14H2,1-2H3,(H,23,26)(H2,22,24,27)