N-[4-[(2-azanyl-3-sulfanyl-propyl)amino]-3,4-dimethyl-2-oxidanylidene-oxolan-3-yl]-N-pentylsulfonyl-3-phenyl-propanamide

Systemtic Name: N-[4-[(2-azanyl-3-sulfanyl-propyl)amino]-3,4-dimethyl-2-oxidanylidene-oxolan-3-yl]-N-pentylsulfonyl-3-phenyl-propanamide Openeye Name: N-[4-[(2-amino-3-sulfanyl-propyl)amino]-3,4-dimethyl-2-oxo-tetrahydrofuran-3-yl]-N-pentylsulfonyl-3-phenyl-propanamide CAS Name: N-[4-[(2-amino-3-mercaptopropyl)amino]-3,4-dimethyl-2-oxo-3-oxolanyl]-N-pentylsulfonyl-3-phenylpropanamide IUPAC Name: N-[4-[(2-amino-3-sulfanylpropyl)amino]-3,4-dimethyl-2-oxooxolan-3-yl]-N-pentylsulfonyl-3-phenylpropanamide Traditional Name: N-[4-[(2-amino-3-mercapto-propyl)amino]-2-keto-3,4-dimethyl-tetrahydrofuran-3-yl]-N-amylsulfonyl-3-phenyl-propionamide Formula: C23H37N3O5S2 MolecularWeight: 499.68698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCS(=O)(=O)N(C(=O)CCC1=CC=CC=C1)C2(C(=O)OCC2(C)NCC(CS)N)C

Isomeric SMILES

CCCCCS(=O)(=O)N(C(=O)CCC1=CC=CC=C1)C2(C(=O)OCC2(C)NCC(CS)N)C

InChI

InChI=1S/C23H37N3O5S2/c1-4-5-9-14-33(29,30)26(20(27)13-12-18-10-7-6-8-11-18)23(3)21(28)31-17-22(23,2)25-15-19(24)16-32/h6-8,10-11,19,25,32H,4-5,9,12-17,24H2,1-3H3