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

Systemtic Name: 1-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]-3-(4-methylsulfanylphenyl)-1-prop-2-enyl-urea Openeye Name: 1-allyl-1-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]-3-(4-methylsulfanylphenyl)urea CAS Name: 1-[[1-[(3-methoxyphenyl)methyl]-2-pyrrolyl]methyl]-3-[4-(methylthio)phenyl]-1-prop-2-enylurea IUPAC Name: 1-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]-3-(4-methylsulfanylphenyl)-1-prop-2-enylurea Traditional Name: 1-allyl-1-[(1-m-anisylpyrrol-2-yl)methyl]-3-[4-(methylthio)phenyl]urea Formula: C24H27N3O2S MolecularWeight: 421.55508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2C=CC=C2CN(CC=C)C(=O)NC3=CC=C(C=C3)SC

Isomeric SMILES

COC1=CC=CC(=C1)CN2C=CC=C2CN(CC=C)C(=O)NC3=CC=C(C=C3)SC

InChI

InChI=1S/C24H27N3O2S/c1-4-14-27(24(28)25-20-10-12-23(30-3)13-11-20)18-21-8-6-15-26(21)17-19-7-5-9-22(16-19)29-2/h4-13,15-16H,1,14,17-18H2,2-3H3,(H,25,28)