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

Systemtic Name: N-[4-[1-[(6-methyl-1,3-benzothiazol-2-yl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]thiophene-2-carboxamide Openeye Name: N-[4-[1-methyl-2-[(6-methyl-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl]sulfanylphenyl]thiophene-2-carboxamide CAS Name: N-[4-[[1-[(6-methyl-1,3-benzothiazol-2-yl)amino]-1-oxopropan-2-yl]thio]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[1-[(6-methyl-1,3-benzothiazol-2-yl)amino]-1-oxopropan-2-yl]sulfanylphenyl]thiophene-2-carboxamide Traditional Name: N-[4-[[2-keto-1-methyl-2-[(6-methyl-1,3-benzothiazol-2-yl)amino]ethyl]thio]phenyl]thiophene-2-carboxamide Formula: C22H19N3O2S3 MolecularWeight: 453.60016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C(C)SC3=CC=C(C=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C(C)SC3=CC=C(C=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C22H19N3O2S3/c1-13-5-10-17-19(12-13)30-22(24-17)25-20(26)14(2)29-16-8-6-15(7-9-16)23-21(27)18-4-3-11-28-18/h3-12,14H,1-2H3,(H,23,27)(H,24,25,26)