N-[2-[(5-chloranylpyridin-2-yl)carbamoyl]-4-methyl-phenyl]-4-propan-2-yl-piperazine-1-carboxamide hydrochloride

Systemtic Name: N-[2-[(5-chloranylpyridin-2-yl)carbamoyl]-4-methyl-phenyl]-4-propan-2-yl-piperazine-1-carboxamide hydrochloride Openeye Name: N-[2-[(5-chloro-2-pyridyl)carbamoyl]-4-methyl-phenyl]-4-isopropyl-piperazine-1-carboxamide hydrochloride CAS Name: N-[2-[[(5-chloro-2-pyridinyl)amino]-oxomethyl]-4-methylphenyl]-4-propan-2-yl-1-piperazinecarboxamide hydrochloride IUPAC Name: N-[2-[(5-chloropyridin-2-yl)carbamoyl]-4-methylphenyl]-4-propan-2-ylpiperazine-1-carboxamide hydrochloride Traditional Name: N-[2-[(5-chloro-2-pyridyl)carbamoyl]-4-methyl-phenyl]-4-isopropyl-piperazine-1-carboxamide hydrochloride Formula: C21H27Cl2N5O2 MolecularWeight: 452.37738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)N2CCN(CC2)C(C)C)C(=O)NC3=NC=C(C=C3)Cl.Cl

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)N2CCN(CC2)C(C)C)C(=O)NC3=NC=C(C=C3)Cl.Cl

InChI

InChI=1S/C21H26ClN5O2.ClH/c1-14(2)26-8-10-27(11-9-26)21(29)24-18-6-4-15(3)12-17(18)20(28)25-19-7-5-16(22)13-23-19;/h4-7,12-14H,8-11H2,1-3H3,(H,24,29)(H,23,25,28);1H