1-[(3-carbamimidoylphenyl)amino]-3-[4-(2-methylsulfonylphenyl)phenyl]-1-propan-2-yl-urea

Systemtic Name: 1-[(3-carbamimidoylphenyl)amino]-3-[4-(2-methylsulfonylphenyl)phenyl]-1-propan-2-yl-urea Openeye Name: 1-(3-carbamimidoylanilino)-1-isopropyl-3-[4-(2-methylsulfonylphenyl)phenyl]urea CAS Name: 1-(3-carbamimidoylanilino)-3-[4-(2-methylsulfonylphenyl)phenyl]-1-propan-2-ylurea IUPAC Name: 1-(3-carbamimidoylanilino)-3-[4-(2-methylsulfonylphenyl)phenyl]-1-propan-2-ylurea Traditional Name: 1-(3-amidinoanilino)-1-isopropyl-3-[4-(2-mesylphenyl)phenyl]urea Formula: C24H27N5O3S MolecularWeight: 465.56788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(=O)NC1=CC=C(C=C1)C2=CC=CC=C2S(=O)(=O)C)NC3=CC=CC(=C3)C(=N)N

Isomeric SMILES

CC(C)N(C(=O)NC1=CC=C(C=C1)C2=CC=CC=C2S(=O)(=O)C)NC3=CC=CC(=C3)C(=N)N

InChI

InChI=1S/C24H27N5O3S/c1-16(2)29(28-20-8-6-7-18(15-20)23(25)26)24(30)27-19-13-11-17(12-14-19)21-9-4-5-10-22(21)33(3,31)32/h4-16,28H,1-3H3,(H3,25,26)(H,27,30)