6-(1,3-benzothiazol-2-ylamino)-N-methyl-N-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]hexanamide

Systemtic Name: 6-(1,3-benzothiazol-2-ylamino)-N-methyl-N-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]hexanamide Openeye Name: 6-(1,3-benzothiazol-2-ylamino)-N-methyl-N-[2-(4-methylanilino)-2-oxo-ethyl]hexanamide CAS Name: 6-(1,3-benzothiazol-2-ylamino)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]hexanamide IUPAC Name: 6-(1,3-benzothiazol-2-ylamino)-N-methyl-N-[2-(4-methylanilino)-2-oxoethyl]hexanamide Traditional Name: 6-(1,3-benzothiazol-2-ylamino)-N-[2-keto-2-(p-toluidino)ethyl]-N-methyl-hexanamide Formula: C23H28N4O2S MolecularWeight: 424.55902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)CCCCCNC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CN(C)C(=O)CCCCCNC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C23H28N4O2S/c1-17-11-13-18(14-12-17)25-21(28)16-27(2)22(29)10-4-3-7-15-24-23-26-19-8-5-6-9-20(19)30-23/h5-6,8-9,11-14H,3-4,7,10,15-16H2,1-2H3,(H,24,26)(H,25,28)