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

Systemtic Name: 1-[(3-carbamimidoylphenyl)amino]-3-[[4-(2-methylsulfonylphenyl)phenyl]amino]-1-propyl-urea Openeye Name: 1-(3-carbamimidoylanilino)-3-[4-(2-methylsulfonylphenyl)anilino]-1-propyl-urea CAS Name: 1-(3-carbamimidoylanilino)-3-[4-(2-methylsulfonylphenyl)anilino]-1-propylurea IUPAC Name: 1-(3-carbamimidoylanilino)-3-[4-(2-methylsulfonylphenyl)anilino]-1-propylurea Traditional Name: 1-(3-amidinoanilino)-3-[4-(2-mesylphenyl)anilino]-1-propyl-urea Formula: C24H28N6O3S MolecularWeight: 480.58252

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C(=O)NNC1=CC=C(C=C1)C2=CC=CC=C2S(=O)(=O)C)NC3=CC=CC(=C3)C(=N)N

Isomeric SMILES

CCCN(C(=O)NNC1=CC=C(C=C1)C2=CC=CC=C2S(=O)(=O)C)NC3=CC=CC(=C3)C(=N)N

InChI

InChI=1S/C24H28N6O3S/c1-3-15-30(29-20-8-6-7-18(16-20)23(25)26)24(31)28-27-19-13-11-17(12-14-19)21-9-4-5-10-22(21)34(2,32)33/h4-14,16,27,29H,3,15H2,1-2H3,(H3,25,26)(H,28,31)