[4-[(1-methoxy-4-methylsulfanyl-1-oxidanylidene-butan-2-yl)carbamoyl]-3-phenyl-phenyl]-(1-methylimidazol-2-yl)carbamic acid

Systemtic Name: [4-[(1-methoxy-4-methylsulfanyl-1-oxidanylidene-butan-2-yl)carbamoyl]-3-phenyl-phenyl]-(1-methylimidazol-2-yl)carbamic acid Openeye Name: [4-[(1-methoxycarbonyl-3-methylsulfanyl-propyl)carbamoyl]-3-phenyl-phenyl]-(1-methylimidazol-2-yl)carbamic acid CAS Name: [4-[[[1-methoxy-4-(methylthio)-1-oxobutan-2-yl]amino]-oxomethyl]-3-phenylphenyl]-(1-methyl-2-imidazolyl)carbamic acid IUPAC Name: [4-[(1-methoxy-4-methylsulfanyl-1-oxobutan-2-yl)carbamoyl]-3-phenylphenyl]-(1-methylimidazol-2-yl)carbamic acid Traditional Name: [4-[[1-carbomethoxy-3-(methylthio)propyl]carbamoyl]-3-phenyl-phenyl]-(1-methylimidazol-2-yl)carbamic acid Formula: C24H26N4O5S MolecularWeight: 482.55204

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1N(C2=CC(=C(C=C2)C(=O)NC(CCSC)C(=O)OC)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CN1C=CN=C1N(C2=CC(=C(C=C2)C(=O)NC(CCSC)C(=O)OC)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C24H26N4O5S/c1-27-13-12-25-23(27)28(24(31)32)17-9-10-18(19(15-17)16-7-5-4-6-8-16)21(29)26-20(11-14-34-3)22(30)33-2/h4-10,12-13,15,20H,11,14H2,1-3H3,(H,26,29)(H,31,32)