(3S)-5-[(3-aminocarbonyl-5-propyl-thiophen-2-yl)amino]-3-methyl-5-oxidanylidene-pentanoic acid

Systemtic Name: (3S)-5-[(3-aminocarbonyl-5-propyl-thiophen-2-yl)amino]-3-methyl-5-oxidanylidene-pentanoic acid Openeye Name: (3S)-5-[(3-carbamoyl-5-propyl-2-thienyl)amino]-3-methyl-5-oxo-pentanoic acid CAS Name: (3S)-5-[(3-carbamoyl-5-propyl-2-thiophenyl)amino]-3-methyl-5-oxopentanoic acid IUPAC Name: (3S)-5-[(3-carbamoyl-5-propylthiophen-2-yl)amino]-3-methyl-5-oxopentanoic acid Traditional Name: (3S)-5-[(3-carbamoyl-5-propyl-2-thienyl)amino]-5-keto-3-methyl-valeric acid Formula: C14H20N2O4S MolecularWeight: 312.3846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(S1)NC(=O)CC(C)CC(=O)O)C(=O)N

Isomeric SMILES

CCCC1=CC(=C(S1)NC(=O)C[C@H](C)CC(=O)O)C(=O)N

InChI

InChI=1S/C14H20N2O4S/c1-3-4-9-7-10(13(15)20)14(21-9)16-11(17)5-8(2)6-12(18)19/h7-8H,3-6H2,1-2H3,(H2,15,20)(H,16,17)(H,18,19)/t8-/m0/s1