methyl 2-[[4-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]sulfonylphenyl]carbamoyl]benzoate

Systemtic Name: methyl 2-[[4-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]sulfonylphenyl]carbamoyl]benzoate Openeye Name: methyl 2-[[4-[[4-(1H-benzimidazol-2-yl)-1-piperidyl]sulfonyl]phenyl]carbamoyl]benzoate CAS Name: 2-[[4-[[4-(1H-benzimidazol-2-yl)-1-piperidinyl]sulfonyl]anilino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[4-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]sulfonylphenyl]carbamoyl]benzoate Traditional Name: 2-[[4-[4-(1H-benzimidazol-2-yl)piperidino]sulfonylphenyl]carbamoyl]benzoic acid methyl ester Formula: C27H26N4O5S MolecularWeight: 518.58414

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)C4=NC5=CC=CC=C5N4

Isomeric SMILES

COC(=O)C1=CC=CC=C1C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C27H26N4O5S/c1-36-27(33)22-7-3-2-6-21(22)26(32)28-19-10-12-20(13-11-19)37(34,35)31-16-14-18(15-17-31)25-29-23-8-4-5-9-24(23)30-25/h2-13,18H,14-17H2,1H3,(H,28,32)(H,29,30)