4-(3-carbamimidoylphenyl)-N-[4-(2-methylsulfonylphenyl)phenyl]butanamide

Systemtic Name: 4-(3-carbamimidoylphenyl)-N-[4-(2-methylsulfonylphenyl)phenyl]butanamide Openeye Name: 4-(3-carbamimidoylphenyl)-N-[4-(2-methylsulfonylphenyl)phenyl]butanamide CAS Name: 4-(3-carbamimidoylphenyl)-N-[4-(2-methylsulfonylphenyl)phenyl]butanamide IUPAC Name: 4-(3-carbamimidoylphenyl)-N-[4-(2-methylsulfonylphenyl)phenyl]butanamide Traditional Name: 4-(3-amidinophenyl)-N-[4-(2-mesylphenyl)phenyl]butyramide Formula: C24H25N3O3S MolecularWeight: 435.5386

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C2=CC=C(C=C2)NC(=O)CCCC3=CC=CC(=C3)C(=N)N

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C2=CC=C(C=C2)NC(=O)CCCC3=CC=CC(=C3)C(=N)N

InChI

InChI=1S/C24H25N3O3S/c1-31(29,30)22-10-3-2-9-21(22)18-12-14-20(15-13-18)27-23(28)11-5-7-17-6-4-8-19(16-17)24(25)26/h2-4,6,8-10,12-16H,5,7,11H2,1H3,(H3,25,26)(H,27,28)