1-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-3-(4-methylsulfanylphenyl)-1-prop-2-enyl-urea

Systemtic Name: 1-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-3-(4-methylsulfanylphenyl)-1-prop-2-enyl-urea Openeye Name: 1-allyl-3-(4-methylsulfanylphenyl)-1-[[1-(o-tolylmethyl)pyrrol-2-yl]methyl]urea CAS Name: 1-[[1-[(2-methylphenyl)methyl]-2-pyrrolyl]methyl]-3-[4-(methylthio)phenyl]-1-prop-2-enylurea IUPAC Name: 1-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-3-(4-methylsulfanylphenyl)-1-prop-2-enylurea Traditional Name: 1-allyl-1-[[1-(2-methylbenzyl)pyrrol-2-yl]methyl]-3-[4-(methylthio)phenyl]urea Formula: C24H27N3OS MolecularWeight: 405.55568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=CC=C2CN(CC=C)C(=O)NC3=CC=C(C=C3)SC

Isomeric SMILES

CC1=CC=CC=C1CN2C=CC=C2CN(CC=C)C(=O)NC3=CC=C(C=C3)SC

InChI

InChI=1S/C24H27N3OS/c1-4-15-27(24(28)25-21-11-13-23(29-3)14-12-21)18-22-10-7-16-26(22)17-20-9-6-5-8-19(20)2/h4-14,16H,1,15,17-18H2,2-3H3,(H,25,28)