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

Systemtic Name: (3S)-5-[(3-aminocarbonyl-5-propyl-thiophen-2-yl)amino]-3-methyl-5-oxidanylidene-pentanoate Openeye Name: (3S)-5-[(3-carbamoyl-5-propyl-2-thienyl)amino]-3-methyl-5-oxo-pentanoate CAS Name: (3S)-5-[(3-carbamoyl-5-propyl-2-thiophenyl)amino]-3-methyl-5-oxopentanoate IUPAC Name: (3S)-5-[(3-carbamoyl-5-propylthiophen-2-yl)amino]-3-methyl-5-oxopentanoate Traditional Name: (3S)-5-[(3-carbamoyl-5-propyl-2-thienyl)amino]-5-keto-3-methyl-valerate Formula: C14H19N2O4S- MolecularWeight: 311.37666

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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)/p-1/t8-/m0/s1