N-(1-adamantylmethyl)-2-(3-azanylpyrrolidin-1-yl)-5-chloranyl-pyridine-4-carboxamide

Systemtic Name: N-(1-adamantylmethyl)-2-(3-azanylpyrrolidin-1-yl)-5-chloranyl-pyridine-4-carboxamide Openeye Name: N-(1-adamantylmethyl)-2-(3-aminopyrrolidin-1-yl)-5-chloro-pyridine-4-carboxamide CAS Name: N-(1-adamantylmethyl)-2-(3-amino-1-pyrrolidinyl)-5-chloro-4-pyridinecarboxamide IUPAC Name: N-(1-adamantylmethyl)-2-(3-aminopyrrolidin-1-yl)-5-chloropyridine-4-carboxamide Traditional Name: N-(1-adamantylmethyl)-2-(3-aminopyrrolidino)-5-chloro-isonicotinamide Formula: C21H29ClN4O MolecularWeight: 388.93416

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1N)C2=NC=C(C(=C2)C(=O)NCC34CC5CC(C3)CC(C5)C4)Cl

Isomeric SMILES

C1CN(CC1N)C2=NC=C(C(=C2)C(=O)NCC34CC5CC(C3)CC(C5)C4)Cl

InChI

InChI=1S/C21H29ClN4O/c22-18-10-24-19(26-2-1-16(23)11-26)6-17(18)20(27)25-12-21-7-13-3-14(8-21)5-15(4-13)9-21/h6,10,13-16H,1-5,7-9,11-12,23H2,(H,25,27)