N-(1-adamantylmethyl)-4-chloranyl-1-pyrimidin-2-yl-indole-3-carboxamide

Systemtic Name: N-(1-adamantylmethyl)-4-chloranyl-1-pyrimidin-2-yl-indole-3-carboxamide Openeye Name: N-(1-adamantylmethyl)-4-chloro-1-pyrimidin-2-yl-indole-3-carboxamide CAS Name: N-(1-adamantylmethyl)-4-chloro-1-(2-pyrimidinyl)-3-indolecarboxamide IUPAC Name: N-(1-adamantylmethyl)-4-chloro-1-pyrimidin-2-ylindole-3-carboxamide Traditional Name: N-(1-adamantylmethyl)-4-chloro-1-(2-pyrimidyl)indole-3-carboxamide Formula: C24H25ClN4O MolecularWeight: 420.9345

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CNC(=O)C4=CN(C5=C4C(=CC=C5)Cl)C6=NC=CC=N6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CNC(=O)C4=CN(C5=C4C(=CC=C5)Cl)C6=NC=CC=N6

InChI

InChI=1S/C24H25ClN4O/c25-19-3-1-4-20-21(19)18(13-29(20)23-26-5-2-6-27-23)22(30)28-14-24-10-15-7-16(11-24)9-17(8-15)12-24/h1-6,13,15-17H,7-12,14H2,(H,28,30)