N-(1-adamantyl)-4-(5-chloranyl-2-pyridin-2-yl-1H-indol-3-yl)butanamide

Systemtic Name: N-(1-adamantyl)-4-(5-chloranyl-2-pyridin-2-yl-1H-indol-3-yl)butanamide Openeye Name: N-(1-adamantyl)-4-[5-chloro-2-(2-pyridyl)-1H-indol-3-yl]butanamide CAS Name: N-(1-adamantyl)-4-[5-chloro-2-(2-pyridinyl)-1H-indol-3-yl]butanamide IUPAC Name: N-(1-adamantyl)-4-(5-chloro-2-pyridin-2-yl-1H-indol-3-yl)butanamide Traditional Name: N-(1-adamantyl)-4-[5-chloro-2-(2-pyridyl)-1H-indol-3-yl]butyramide Formula: C27H30ClN3O MolecularWeight: 447.9996

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)CCCC4=C(NC5=C4C=C(C=C5)Cl)C6=CC=CC=N6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)CCCC4=C(NC5=C4C=C(C=C5)Cl)C6=CC=CC=N6

InChI

InChI=1S/C27H30ClN3O/c28-20-7-8-23-22(13-20)21(26(30-23)24-5-1-2-9-29-24)4-3-6-25(32)31-27-14-17-10-18(15-27)12-19(11-17)16-27/h1-2,5,7-9,13,17-19,30H,3-4,6,10-12,14-16H2,(H,31,32)