2-[[5-[[4-(2-benzamidoethyl)phenyl]sulfonylcarbamoyl]pyridin-2-yl]carbonylamino]ethyl 2-methylbenzoate

Systemtic Name: 2-[[5-[[4-(2-benzamidoethyl)phenyl]sulfonylcarbamoyl]pyridin-2-yl]carbonylamino]ethyl 2-methylbenzoate Openeye Name: 2-[[5-[[4-(2-benzamidoethyl)phenyl]sulfonylcarbamoyl]pyridine-2-carbonyl]amino]ethyl 2-methylbenzoate CAS Name: 2-methylbenzoic acid 2-[[[5-[[[4-(2-benzamidoethyl)phenyl]sulfonylamino]-oxomethyl]-2-pyridinyl]-oxomethyl]amino]ethyl ester IUPAC Name: 2-[[5-[[4-(2-benzamidoethyl)phenyl]sulfonylcarbamoyl]pyridine-2-carbonyl]amino]ethyl 2-methylbenzoate Traditional Name: 2-methylbenzoic acid 2-[[5-[[4-(2-benzamidoethyl)phenyl]sulfonylcarbamoyl]picolinoyl]amino]ethyl ester Formula: C32H30N4O7S MolecularWeight: 614.6682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)OCCNC(=O)C2=NC=C(C=C2)C(=O)NS(=O)(=O)C3=CC=C(C=C3)CCNC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1C(=O)OCCNC(=O)C2=NC=C(C=C2)C(=O)NS(=O)(=O)C3=CC=C(C=C3)CCNC(=O)C4=CC=CC=C4

InChI

InChI=1S/C32H30N4O7S/c1-22-7-5-6-10-27(22)32(40)43-20-19-34-31(39)28-16-13-25(21-35-28)30(38)36-44(41,42)26-14-11-23(12-15-26)17-18-33-29(37)24-8-3-2-4-9-24/h2-16,21H,17-20H2,1H3,(H,33,37)(H,34,39)(H,36,38)