1-[4-azanyl-6-methylsulfanyl-1,3-bis(oxidanylidene)-2-phenyl-hexan-2-yl]-3-[3-(4-methoxyphenyl)-2-methyl-phenyl]urea

Systemtic Name: 1-[4-azanyl-6-methylsulfanyl-1,3-bis(oxidanylidene)-2-phenyl-hexan-2-yl]-3-[3-(4-methoxyphenyl)-2-methyl-phenyl]urea Openeye Name: 1-(3-amino-1-formyl-5-methylsulfanyl-2-oxo-1-phenyl-pentyl)-3-[3-(4-methoxyphenyl)-2-methyl-phenyl]urea CAS Name: 1-[4-amino-6-(methylthio)-1,3-dioxo-2-phenylhexan-2-yl]-3-[3-(4-methoxyphenyl)-2-methylphenyl]urea IUPAC Name: 1-(4-amino-6-methylsulfanyl-1,3-dioxo-2-phenylhexan-2-yl)-3-[3-(4-methoxyphenyl)-2-methylphenyl]urea Traditional Name: 1-[3-amino-1-formyl-2-keto-5-(methylthio)-1-phenyl-pentyl]-3-[3-(4-methoxyphenyl)-2-methyl-phenyl]urea Formula: C28H31N3O4S MolecularWeight: 505.62844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)NC(C=O)(C2=CC=CC=C2)C(=O)C(CCSC)N)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)NC(C=O)(C2=CC=CC=C2)C(=O)C(CCSC)N)C3=CC=C(C=C3)OC

InChI

InChI=1S/C28H31N3O4S/c1-19-23(20-12-14-22(35-2)15-13-20)10-7-11-25(19)30-27(34)31-28(18-32,21-8-5-4-6-9-21)26(33)24(29)16-17-36-3/h4-15,18,24H,16-17,29H2,1-3H3,(H2,30,31,34)