N-(2,6-dimethylphenyl)-2-[2-(5-methoxy-1H-indol-3-yl)ethylcarbamoylamino]-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[2-(5-methoxy-1H-indol-3-yl)ethylcarbamoylamino]-1,3-benzothiazole-6-carboxamide Openeye Name: N-(2,6-dimethylphenyl)-2-[2-(5-methoxy-1H-indol-3-yl)ethylcarbamoylamino]-1,3-benzothiazole-6-carboxamide CAS Name: N-(2,6-dimethylphenyl)-2-[[[2-(5-methoxy-1H-indol-3-yl)ethylamino]-oxomethyl]amino]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[2-(5-methoxy-1H-indol-3-yl)ethylcarbamoylamino]-1,3-benzothiazole-6-carboxamide Traditional Name: N-(2,6-dimethylphenyl)-2-[2-(5-methoxy-1H-indol-3-yl)ethylcarbamoylamino]-1,3-benzothiazole-6-carboxamide Formula: C28H27N5O3S MolecularWeight: 513.61068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)NCCC4=CNC5=C4C=C(C=C5)OC

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C2=CC3=C(C=C2)N=C(S3)NC(=O)NCCC4=CNC5=C4C=C(C=C5)OC

InChI

InChI=1S/C28H27N5O3S/c1-16-5-4-6-17(2)25(16)32-26(34)18-7-9-23-24(13-18)37-28(31-23)33-27(35)29-12-11-19-15-30-22-10-8-20(36-3)14-21(19)22/h4-10,13-15,30H,11-12H2,1-3H3,(H,32,34)(H2,29,31,33,35)