4-[4-(1,3-benzothiazol-6-ylamino)-1H-pyrrolo[2,3-b]pyridin-2-yl]-N-butyl-3,6-dihydro-2H-pyridine-1-carboxamide

Systemtic Name: 4-[4-(1,3-benzothiazol-6-ylamino)-1H-pyrrolo[2,3-b]pyridin-2-yl]-N-butyl-3,6-dihydro-2H-pyridine-1-carboxamide Openeye Name: 4-[4-(1,3-benzothiazol-6-ylamino)-1H-pyrrolo[2,3-b]pyridin-2-yl]-N-butyl-3,6-dihydro-2H-pyridine-1-carboxamide CAS Name: 4-[4-(1,3-benzothiazol-6-ylamino)-1H-pyrrolo[2,3-b]pyridin-2-yl]-N-butyl-3,6-dihydro-2H-pyridine-1-carboxamide IUPAC Name: 4-[4-(1,3-benzothiazol-6-ylamino)-1H-pyrrolo[2,3-b]pyridin-2-yl]-N-butyl-3,6-dihydro-2H-pyridine-1-carboxamide Traditional Name: 4-[4-(1,3-benzothiazol-6-ylamino)-1H-pyrrolo[2,3-b]pyridin-2-yl]-N-butyl-3,6-dihydro-2H-pyridine-1-carboxamide Formula: C24H26N6OS MolecularWeight: 446.56784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N1CCC(=CC1)C2=CC3=C(C=CN=C3N2)NC4=CC5=C(C=C4)N=CS5

Isomeric SMILES

CCCCNC(=O)N1CCC(=CC1)C2=CC3=C(C=CN=C3N2)NC4=CC5=C(C=C4)N=CS5

InChI

InChI=1S/C24H26N6OS/c1-2-3-9-26-24(31)30-11-7-16(8-12-30)21-14-18-19(6-10-25-23(18)29-21)28-17-4-5-20-22(13-17)32-15-27-20/h4-7,10,13-15H,2-3,8-9,11-12H2,1H3,(H,26,31)(H2,25,28,29)