N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]-3-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]-3-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-1-benzofuran-2-carboxamide Openeye Name: N-[1-(2-amino-2-oxo-ethyl)-4-piperidyl]-3-[(4-methylthiazol-2-yl)sulfanylmethyl]benzofuran-2-carboxamide CAS Name: N-[1-(2-amino-2-oxoethyl)-4-piperidinyl]-3-[[(4-methyl-2-thiazolyl)thio]methyl]-2-benzofurancarboxamide IUPAC Name: N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-3-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]-1-benzofuran-2-carboxamide Traditional Name: N-[1-(2-amino-2-keto-ethyl)-4-piperidyl]-3-[[(4-methylthiazol-2-yl)thio]methyl]coumarilamide Formula: C21H24N4O3S2 MolecularWeight: 444.57026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SCC2=C(OC3=CC=CC=C32)C(=O)NC4CCN(CC4)CC(=O)N

Isomeric SMILES

CC1=CSC(=N1)SCC2=C(OC3=CC=CC=C32)C(=O)NC4CCN(CC4)CC(=O)N

InChI

InChI=1S/C21H24N4O3S2/c1-13-11-29-21(23-13)30-12-16-15-4-2-3-5-17(15)28-19(16)20(27)24-14-6-8-25(9-7-14)10-18(22)26/h2-5,11,14H,6-10,12H2,1H3,(H2,22,26)(H,24,27)