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

Systemtic Name: N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-3-(cyclohexylsulfanylmethyl)-1-benzofuran-2-carboxamide Openeye Name: N-[5-(2-amino-2-oxo-ethyl)sulfanyl-4-methyl-thiazol-2-yl]-3-(cyclohexylsulfanylmethyl)benzofuran-2-carboxamide CAS Name: N-[5-[(2-amino-2-oxoethyl)thio]-4-methyl-2-thiazolyl]-3-[(cyclohexylthio)methyl]-2-benzofurancarboxamide IUPAC Name: N-[5-(2-amino-2-oxoethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-3-(cyclohexylsulfanylmethyl)-1-benzofuran-2-carboxamide Traditional Name: N-[5-[(2-amino-2-keto-ethyl)thio]-4-methyl-thiazol-2-yl]-3-[(cyclohexylthio)methyl]coumarilamide Formula: C22H25N3O3S3 MolecularWeight: 475.6472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=C(C3=CC=CC=C3O2)CSC4CCCCC4)SCC(=O)N

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=C(C3=CC=CC=C3O2)CSC4CCCCC4)SCC(=O)N

InChI

InChI=1S/C22H25N3O3S3/c1-13-21(30-12-18(23)26)31-22(24-13)25-20(27)19-16(11-29-14-7-3-2-4-8-14)15-9-5-6-10-17(15)28-19/h5-6,9-10,14H,2-4,7-8,11-12H2,1H3,(H2,23,26)(H,24,25,27)