N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzamide

Systemtic Name: N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzamide Openeye Name: N-[5-(2-amino-2-oxo-ethyl)sulfanyl-4-methyl-thiazol-2-yl]-4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzamide CAS Name: N-[5-[(2-amino-2-oxoethyl)thio]-4-methyl-2-thiazolyl]-4-[(1,3-benzothiazol-2-ylthio)methyl]benzamide IUPAC Name: N-[5-(2-amino-2-oxoethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzamide Traditional Name: N-[5-[(2-amino-2-keto-ethyl)thio]-4-methyl-thiazol-2-yl]-4-[(1,3-benzothiazol-2-ylthio)methyl]benzamide Formula: C21H18N4O2S4 MolecularWeight: 486.65322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4S3)SCC(=O)N

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4S3)SCC(=O)N

InChI

InChI=1S/C21H18N4O2S4/c1-12-19(28-11-17(22)26)31-20(23-12)25-18(27)14-8-6-13(7-9-14)10-29-21-24-15-4-2-3-5-16(15)30-21/h2-9H,10-11H2,1H3,(H2,22,26)(H,23,25,27)