3-(3-carbamimidoylphenyl)-N-[4-(2-ethylsulfonylphenyl)phenyl]-2-phenyl-propanamide

Systemtic Name: 3-(3-carbamimidoylphenyl)-N-[4-(2-ethylsulfonylphenyl)phenyl]-2-phenyl-propanamide Openeye Name: 3-(3-carbamimidoylphenyl)-N-[4-(2-ethylsulfonylphenyl)phenyl]-2-phenyl-propanamide CAS Name: 3-(3-carbamimidoylphenyl)-N-[4-(2-ethylsulfonylphenyl)phenyl]-2-phenylpropanamide IUPAC Name: 3-(3-carbamimidoylphenyl)-N-[4-(2-ethylsulfonylphenyl)phenyl]-2-phenylpropanamide Traditional Name: 3-(3-amidinophenyl)-N-[4-(2-esylphenyl)phenyl]-2-phenyl-propionamide Formula: C30H29N3O3S MolecularWeight: 511.63456

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=CC=C1C2=CC=C(C=C2)NC(=O)C(CC3=CC=CC(=C3)C(=N)N)C4=CC=CC=C4

Isomeric SMILES

CCS(=O)(=O)C1=CC=CC=C1C2=CC=C(C=C2)NC(=O)C(CC3=CC=CC(=C3)C(=N)N)C4=CC=CC=C4

InChI

InChI=1S/C30H29N3O3S/c1-2-37(35,36)28-14-7-6-13-26(28)23-15-17-25(18-16-23)33-30(34)27(22-10-4-3-5-11-22)20-21-9-8-12-24(19-21)29(31)32/h3-19,27H,2,20H2,1H3,(H3,31,32)(H,33,34)