N-[3-(cyclopropylamino)-4-oxidanylidene-4-[oxidanyl-(4-phenoxyphenyl)sulfonyl-amino]butyl]-2-methanoyl-benzamide

Systemtic Name: N-[3-(cyclopropylamino)-4-oxidanylidene-4-[oxidanyl-(4-phenoxyphenyl)sulfonyl-amino]butyl]-2-methanoyl-benzamide Openeye Name: N-[3-(cyclopropylamino)-4-[hydroxy-(4-phenoxyphenyl)sulfonyl-amino]-4-oxo-butyl]-2-formyl-benzamide CAS Name: N-[3-(cyclopropylamino)-4-[hydroxy-(4-phenoxyphenyl)sulfonylamino]-4-oxobutyl]-2-formylbenzamide IUPAC Name: N-[3-(cyclopropylamino)-4-[hydroxy-(4-phenoxyphenyl)sulfonylamino]-4-oxobutyl]-2-formylbenzamide Traditional Name: N-[3-(cyclopropylamino)-4-[hydroxy-(4-phenoxyphenyl)sulfonyl-amino]-4-keto-butyl]-2-formyl-benzamide Formula: C27H27N3O7S MolecularWeight: 537.58418

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(CCNC(=O)C2=CC=CC=C2C=O)C(=O)N(O)S(=O)(=O)C3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

C1CC1NC(CCNC(=O)C2=CC=CC=C2C=O)C(=O)N(O)S(=O)(=O)C3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C27H27N3O7S/c31-18-19-6-4-5-9-24(19)26(32)28-17-16-25(29-20-10-11-20)27(33)30(34)38(35,36)23-14-12-22(13-15-23)37-21-7-2-1-3-8-21/h1-9,12-15,18,20,25,29,34H,10-11,16-17H2,(H,28,32)