N-[6-(1,3-benzothiazol-2-ylamino)-6-oxidanylidene-hexyl]-1H-indole-2-carboxamide

Systemtic Name: N-[6-(1,3-benzothiazol-2-ylamino)-6-oxidanylidene-hexyl]-1H-indole-2-carboxamide Openeye Name: N-[6-(1,3-benzothiazol-2-ylamino)-6-oxo-hexyl]-1H-indole-2-carboxamide CAS Name: N-[6-(1,3-benzothiazol-2-ylamino)-6-oxohexyl]-1H-indole-2-carboxamide IUPAC Name: N-[6-(1,3-benzothiazol-2-ylamino)-6-oxohexyl]-1H-indole-2-carboxamide Traditional Name: N-[6-(1,3-benzothiazol-2-ylamino)-6-keto-hexyl]-1H-indole-2-carboxamide Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(N2)C(=O)NCCCCCC(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C2C(=C1)C=C(N2)C(=O)NCCCCCC(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H22N4O2S/c27-20(26-22-25-17-10-5-6-11-19(17)29-22)12-2-1-7-13-23-21(28)18-14-15-8-3-4-9-16(15)24-18/h3-6,8-11,14,24H,1-2,7,12-13H2,(H,23,28)(H,25,26,27)