N-(4-azanyl-4-oxidanylidene-butyl)-1-[2-(methylamino)propanoyl]-4-(2-thiophen-2-ylethanoylamino)piperidine-2-carboxamide

Systemtic Name: N-(4-azanyl-4-oxidanylidene-butyl)-1-[2-(methylamino)propanoyl]-4-(2-thiophen-2-ylethanoylamino)piperidine-2-carboxamide Openeye Name: N-(4-amino-4-oxo-butyl)-1-[2-(methylamino)propanoyl]-4-[[2-(2-thienyl)acetyl]amino]piperidine-2-carboxamide CAS Name: N-(4-amino-4-oxobutyl)-1-[2-(methylamino)-1-oxopropyl]-4-[(1-oxo-2-thiophen-2-ylethyl)amino]-2-piperidinecarboxamide IUPAC Name: N-(4-amino-4-oxobutyl)-1-[2-(methylamino)propanoyl]-4-[(2-thiophen-2-ylacetyl)amino]piperidine-2-carboxamide Traditional Name: N-(4-amino-4-keto-butyl)-1-[2-(methylamino)propanoyl]-4-[[2-(2-thienyl)acetyl]amino]pipecolinamide Formula: C20H31N5O4S MolecularWeight: 437.55624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC(CC1C(=O)NCCCC(=O)N)NC(=O)CC2=CC=CS2)NC

Isomeric SMILES

CC(C(=O)N1CCC(CC1C(=O)NCCCC(=O)N)NC(=O)CC2=CC=CS2)NC

InChI

InChI=1S/C20H31N5O4S/c1-13(22-2)20(29)25-9-7-14(24-18(27)12-15-5-4-10-30-15)11-16(25)19(28)23-8-3-6-17(21)26/h4-5,10,13-14,16,22H,3,6-9,11-12H2,1-2H3,(H2,21,26)(H,23,28)(H,24,27)