N,N'-dipentyl-2-[(3-phenyl-2-sulfanyl-propanoyl)amino]propanediamide

Systemtic Name: N,N'-dipentyl-2-[(3-phenyl-2-sulfanyl-propanoyl)amino]propanediamide Openeye Name: N,N'-dipentyl-2-[(3-phenyl-2-sulfanyl-propanoyl)amino]propanediamide CAS Name: 2-[(2-mercapto-1-oxo-3-phenylpropyl)amino]-N,N'-dipentylpropanediamide IUPAC Name: N,N'-dipentyl-2-[(3-phenyl-2-sulfanylpropanoyl)amino]propanediamide Traditional Name: N,N'-diamyl-2-[(2-mercapto-3-phenyl-propanoyl)amino]malonamide Formula: C22H35N3O3S MolecularWeight: 421.5966

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C(C(=O)NCCCCC)NC(=O)C(CC1=CC=CC=C1)S

Isomeric SMILES

CCCCCNC(=O)C(C(=O)NCCCCC)NC(=O)C(CC1=CC=CC=C1)S

InChI

InChI=1S/C22H35N3O3S/c1-3-5-10-14-23-21(27)19(22(28)24-15-11-6-4-2)25-20(26)18(29)16-17-12-8-7-9-13-17/h7-9,12-13,18-19,29H,3-6,10-11,14-16H2,1-2H3,(H,23,27)(H,24,28)(H,25,26)