N1-[4-[ethyl-[(phenylmethyl)sulfonylamino]amino]-3-oxidanyl-1-phenyl-butan-2-yl]-5-ethynyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide

Systemtic Name: N1-[4-[ethyl-[(phenylmethyl)sulfonylamino]amino]-3-oxidanyl-1-phenyl-butan-2-yl]-5-ethynyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide Openeye Name: N1-[1-benzyl-3-[(benzylsulfonylamino)-ethyl-amino]-2-hydroxy-propyl]-5-ethynyl-N3,N3-dipropyl-benzene-1,3-dicarboxamide CAS Name: N1-[4-[ethyl-[(phenylmethyl)sulfonylamino]amino]-3-hydroxy-1-phenylbutan-2-yl]-5-ethynyl-N3,N3-dipropylbenzene-1,3-dicarboxamide IUPAC Name: 1-N-[4-[(benzylsulfonylamino)-ethylamino]-3-hydroxy-1-phenylbutan-2-yl]-5-ethynyl-3-N,3-N-dipropylbenzene-1,3-dicarboxamide Traditional Name: N-[1-benzyl-3-[(benzylsulfonylamino)-ethyl-amino]-2-hydroxy-propyl]-5-ethynyl-N',N'-dipropyl-isophthalamide Formula: C35H44N4O5S MolecularWeight: 632.81266

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)C1=CC(=CC(=C1)C(=O)NC(CC2=CC=CC=C2)C(CN(CC)NS(=O)(=O)CC3=CC=CC=C3)O)C#C

Isomeric SMILES

CCCN(CCC)C(=O)C1=CC(=CC(=C1)C(=O)NC(CC2=CC=CC=C2)C(CN(CC)NS(=O)(=O)CC3=CC=CC=C3)O)C#C

InChI

InChI=1S/C35H44N4O5S/c1-5-19-38(20-6-2)35(42)31-22-27(7-3)21-30(24-31)34(41)36-32(23-28-15-11-9-12-16-28)33(40)25-39(8-4)37-45(43,44)26-29-17-13-10-14-18-29/h3,9-18,21-22,24,32-33,37,40H,5-6,8,19-20,23,25-26H2,1-2,4H3,(H,36,41)