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

Systemtic Name: 1-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-3-(4-methylsulfanylphenyl)-1-propan-2-yl-urea Openeye Name: 1-isopropyl-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-propan-2-ylurea IUPAC Name: 1-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]-3-(4-methylsulfanylphenyl)-1-propan-2-ylurea Traditional Name: 1-isopropyl-1-[[1-(3-methylbenzyl)pyrrol-2-yl]methyl]-3-[4-(methylthio)phenyl]urea Formula: C24H29N3OS MolecularWeight: 407.57156

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H29N3OS/c1-18(2)27(24(28)25-21-10-12-23(29-4)13-11-21)17-22-9-6-14-26(22)16-20-8-5-7-19(3)15-20/h5-15,18H,16-17H2,1-4H3,(H,25,28)