2-(1-adamantyl)-N-[2-[(3S)-3-azanylpyrrolidin-1-yl]-6-methyl-quinolin-5-yl]ethanamide hydrochloride

Systemtic Name: 2-(1-adamantyl)-N-[2-[(3S)-3-azanylpyrrolidin-1-yl]-6-methyl-quinolin-5-yl]ethanamide hydrochloride Openeye Name: 2-(1-adamantyl)-N-[2-[(3S)-3-aminopyrrolidin-1-yl]-6-methyl-5-quinolyl]acetamide hydrochloride CAS Name: 2-(1-adamantyl)-N-[2-[(3S)-3-amino-1-pyrrolidinyl]-6-methyl-5-quinolinyl]acetamide hydrochloride IUPAC Name: 2-(1-adamantyl)-N-[2-[(3S)-3-aminopyrrolidin-1-yl]-6-methylquinolin-5-yl]acetamide hydrochloride Traditional Name: 2-(1-adamantyl)-N-[2-[(3S)-3-aminopyrrolidino]-6-methyl-5-quinolyl]acetamide hydrochloride Formula: C26H35ClN4O MolecularWeight: 455.0353

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)N=C(C=C2)N3CCC(C3)N)NC(=O)CC45CC6CC(C4)CC(C6)C5.Cl

Isomeric SMILES

CC1=C(C2=C(C=C1)N=C(C=C2)N3CC[C@@H](C3)N)NC(=O)CC45CC6CC(C4)CC(C6)C5.Cl

InChI

InChI=1S/C26H34N4O.ClH/c1-16-2-4-22-21(3-5-23(28-22)30-7-6-20(27)15-30)25(16)29-24(31)14-26-11-17-8-18(12-26)10-19(9-17)13-26;/h2-5,17-20H,6-15,27H2,1H3,(H,29,31);1H/t17?,18?,19?,20-,26?;/m0./s1