N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide

Systemtic Name: N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide Openeye Name: N-[5-(2-amino-2-oxo-ethyl)sulfanyl-4-methyl-thiazol-2-yl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide CAS Name: N-[5-[(2-amino-2-oxoethyl)thio]-4-methyl-2-thiazolyl]-1-[oxo(thiophen-2-yl)methyl]-3-piperidinecarboxamide IUPAC Name: N-[5-(2-amino-2-oxoethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide Traditional Name: N-[5-[(2-amino-2-keto-ethyl)thio]-4-methyl-thiazol-2-yl]-1-(2-thenoyl)nipecotamide Formula: C17H20N4O3S3 MolecularWeight: 424.5607

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2CCCN(C2)C(=O)C3=CC=CS3)SCC(=O)N

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2CCCN(C2)C(=O)C3=CC=CS3)SCC(=O)N

InChI

InChI=1S/C17H20N4O3S3/c1-10-16(26-9-13(18)22)27-17(19-10)20-14(23)11-4-2-6-21(8-11)15(24)12-5-3-7-25-12/h3,5,7,11H,2,4,6,8-9H2,1H3,(H2,18,22)(H,19,20,23)