N-[4-[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]thiophene-2-carboxamide Openeye Name: N-[4-[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl]sulfanylphenyl]thiophene-2-carboxamide CAS Name: N-[4-[[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]thio]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxoethyl]sulfanylphenyl]thiophene-2-carboxamide Traditional Name: N-[4-[[2-keto-2-[(6-methyl-1,3-benzothiazol-2-yl)amino]ethyl]thio]phenyl]thiophene-2-carboxamide Formula: C21H17N3O2S3 MolecularWeight: 439.57358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=CC=C(C=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=CC=C(C=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C21H17N3O2S3/c1-13-4-9-16-18(11-13)29-21(23-16)24-19(25)12-28-15-7-5-14(6-8-15)22-20(26)17-3-2-10-27-17/h2-11H,12H2,1H3,(H,22,26)(H,23,24,25)