1-cyclopropyl-3-(4-methylsulfanylphenyl)-1-[[1-(phenylmethyl)pyrrol-2-yl]methyl]urea

Systemtic Name: 1-cyclopropyl-3-(4-methylsulfanylphenyl)-1-[[1-(phenylmethyl)pyrrol-2-yl]methyl]urea Openeye Name: 1-[(1-benzylpyrrol-2-yl)methyl]-1-cyclopropyl-3-(4-methylsulfanylphenyl)urea CAS Name: 1-cyclopropyl-3-[4-(methylthio)phenyl]-1-[[1-(phenylmethyl)-2-pyrrolyl]methyl]urea IUPAC Name: 1-[(1-benzylpyrrol-2-yl)methyl]-1-cyclopropyl-3-(4-methylsulfanylphenyl)urea Traditional Name: 1-[(1-benzylpyrrol-2-yl)methyl]-1-cyclopropyl-3-[4-(methylthio)phenyl]urea Formula: C23H25N3OS MolecularWeight: 391.5291

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC(=O)N(CC2=CC=CN2CC3=CC=CC=C3)C4CC4

Isomeric SMILES

CSC1=CC=C(C=C1)NC(=O)N(CC2=CC=CN2CC3=CC=CC=C3)C4CC4

InChI

InChI=1S/C23H25N3OS/c1-28-22-13-9-19(10-14-22)24-23(27)26(20-11-12-20)17-21-8-5-15-25(21)16-18-6-3-2-4-7-18/h2-10,13-15,20H,11-12,16-17H2,1H3,(H,24,27)