4-[[(2R)-2-acetamido-3-sulfanyl-propanoyl]amino]-N-(4-phenyl-1,3-thiazol-2-yl)butanamide

Systemtic Name: 4-[[(2R)-2-acetamido-3-sulfanyl-propanoyl]amino]-N-(4-phenyl-1,3-thiazol-2-yl)butanamide Openeye Name: 4-[[(2R)-2-acetamido-3-sulfanyl-propanoyl]amino]-N-(4-phenylthiazol-2-yl)butanamide CAS Name: 4-[[(2R)-2-acetamido-3-mercapto-1-oxopropyl]amino]-N-(4-phenyl-2-thiazolyl)butanamide IUPAC Name: 4-[[(2R)-2-acetamido-3-sulfanylpropanoyl]amino]-N-(4-phenyl-1,3-thiazol-2-yl)butanamide Traditional Name: 4-[[(2R)-2-acetamido-3-mercapto-propanoyl]amino]-N-(4-phenylthiazol-2-yl)butyramide Formula: C18H22N4O3S2 MolecularWeight: 406.52228

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CS)C(=O)NCCCC(=O)NC1=NC(=CS1)C2=CC=CC=C2

Isomeric SMILES

CC(=O)N[C@@H](CS)C(=O)NCCCC(=O)NC1=NC(=CS1)C2=CC=CC=C2

InChI

InChI=1S/C18H22N4O3S2/c1-12(23)20-14(10-26)17(25)19-9-5-8-16(24)22-18-21-15(11-27-18)13-6-3-2-4-7-13/h2-4,6-7,11,14,26H,5,8-10H2,1H3,(H,19,25)(H,20,23)(H,21,22,24)/t14-/m0/s1