1-[2-[3-(5-carbamimidoyl-2-methylsulfanyl-thiophen-3-yl)sulfonylphenyl]-5-methoxy-3-methyl-phenyl]-3-(2-methylsulfonylethyl)urea

Systemtic Name: 1-[2-[3-(5-carbamimidoyl-2-methylsulfanyl-thiophen-3-yl)sulfonylphenyl]-5-methoxy-3-methyl-phenyl]-3-(2-methylsulfonylethyl)urea Openeye Name: 1-[2-[3-[(5-carbamimidoyl-2-methylsulfanyl-3-thienyl)sulfonyl]phenyl]-5-methoxy-3-methyl-phenyl]-3-(2-methylsulfonylethyl)urea CAS Name: 1-[2-[3-[[5-carbamimidoyl-2-(methylthio)-3-thiophenyl]sulfonyl]phenyl]-5-methoxy-3-methylphenyl]-3-(2-methylsulfonylethyl)urea IUPAC Name: 1-[2-[3-(5-carbamimidoyl-2-methylsulfanylthiophen-3-yl)sulfonylphenyl]-5-methoxy-3-methylphenyl]-3-(2-methylsulfonylethyl)urea Traditional Name: 1-[2-[3-[[5-amidino-2-(methylthio)-3-thienyl]sulfonyl]phenyl]-5-methoxy-3-methyl-phenyl]-3-(2-mesylethyl)urea Formula: C24H28N4O6S4 MolecularWeight: 596.76232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C2=CC(=CC=C2)S(=O)(=O)C3=C(SC(=C3)C(=N)N)SC)NC(=O)NCCS(=O)(=O)C)OC

Isomeric SMILES

CC1=CC(=CC(=C1C2=CC(=CC=C2)S(=O)(=O)C3=C(SC(=C3)C(=N)N)SC)NC(=O)NCCS(=O)(=O)C)OC

InChI

InChI=1S/C24H28N4O6S4/c1-14-10-16(34-2)12-18(28-24(29)27-8-9-37(4,30)31)21(14)15-6-5-7-17(11-15)38(32,33)20-13-19(22(25)26)36-23(20)35-3/h5-7,10-13H,8-9H2,1-4H3,(H3,25,26)(H2,27,28,29)