N-[4-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)amino]-4-oxidanylidene-butyl]thiophene-3-carboxamide

Systemtic Name: N-[4-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)amino]-4-oxidanylidene-butyl]thiophene-3-carboxamide Openeye Name: N-[4-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)amino]-4-oxo-butyl]thiophene-3-carboxamide CAS Name: N-[4-[[2-(methylthio)-1,3-benzothiazol-6-yl]amino]-4-oxobutyl]-3-thiophenecarboxamide IUPAC Name: N-[4-[(2-methylsulfanyl-1,3-benzothiazol-6-yl)amino]-4-oxobutyl]thiophene-3-carboxamide Traditional Name: N-[4-keto-4-[[2-(methylthio)-1,3-benzothiazol-6-yl]amino]butyl]thiophene-3-carboxamide Formula: C17H17N3O2S3 MolecularWeight: 391.53078

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)CCCNC(=O)C3=CSC=C3

Isomeric SMILES

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)CCCNC(=O)C3=CSC=C3

InChI

InChI=1S/C17H17N3O2S3/c1-23-17-20-13-5-4-12(9-14(13)25-17)19-15(21)3-2-7-18-16(22)11-6-8-24-10-11/h4-6,8-10H,2-3,7H2,1H3,(H,18,22)(H,19,21)