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

Systemtic Name: 1-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-3-(4-methylsulfanylphenyl)-1-prop-2-enyl-urea Openeye Name: 1-allyl-3-(4-methylsulfanylphenyl)-1-[[1-(m-tolylmethyl)pyrrol-2-yl]methyl]urea CAS Name: 1-[[1-[(3-methylphenyl)methyl]-2-pyrrolyl]methyl]-3-[4-(methylthio)phenyl]-1-prop-2-enylurea IUPAC Name: 1-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-3-(4-methylsulfanylphenyl)-1-prop-2-enylurea Traditional Name: 1-allyl-1-[[1-(3-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=C1)CN2C=CC=C2CN(CC=C)C(=O)NC3=CC=C(C=C3)SC

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=CC=C2CN(CC=C)C(=O)NC3=CC=C(C=C3)SC

InChI

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