3-(3-carbamimidoylphenyl)-4-(furan-2-yl)-N-[4-(2-sulfamoylphenyl)phenyl]butanamide

Systemtic Name: 3-(3-carbamimidoylphenyl)-4-(furan-2-yl)-N-[4-(2-sulfamoylphenyl)phenyl]butanamide Openeye Name: 3-(3-carbamimidoylphenyl)-4-(2-furyl)-N-[4-(2-sulfamoylphenyl)phenyl]butanamide CAS Name: 3-(3-carbamimidoylphenyl)-4-(2-furanyl)-N-[4-(2-sulfamoylphenyl)phenyl]butanamide IUPAC Name: 3-(3-carbamimidoylphenyl)-4-(furan-2-yl)-N-[4-(2-sulfamoylphenyl)phenyl]butanamide Traditional Name: 3-(3-amidinophenyl)-4-(2-furyl)-N-[4-(2-sulfamoylphenyl)phenyl]butyramide Formula: C27H26N4O4S MolecularWeight: 502.58474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC=C(C=C2)NC(=O)CC(CC3=CC=CO3)C4=CC=CC(=C4)C(=N)N)S(=O)(=O)N

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC=C(C=C2)NC(=O)CC(CC3=CC=CO3)C4=CC=CC(=C4)C(=N)N)S(=O)(=O)N

InChI

InChI=1S/C27H26N4O4S/c28-27(29)20-6-3-5-19(15-20)21(16-23-7-4-14-35-23)17-26(32)31-22-12-10-18(11-13-22)24-8-1-2-9-25(24)36(30,33)34/h1-15,21H,16-17H2,(H3,28,29)(H,31,32)(H2,30,33,34)