N-[(1S)-3-[4-[ethyl-[2-(4-methylsulfonylphenyl)ethanoyl]amino]piperidin-1-yl]-1-phenyl-propyl]-5-propan-2-yl-2H-1,2,3-triazole-4-carboxamide hydrochloride

Systemtic Name: N-[(1S)-3-[4-[ethyl-[2-(4-methylsulfonylphenyl)ethanoyl]amino]piperidin-1-yl]-1-phenyl-propyl]-5-propan-2-yl-2H-1,2,3-triazole-4-carboxamide hydrochloride Openeye Name: N-[(1S)-3-[4-[ethyl-[2-(4-methylsulfonylphenyl)acetyl]amino]-1-piperidyl]-1-phenyl-propyl]-5-isopropyl-2H-triazole-4-carboxamide hydrochloride CAS Name: N-[(1S)-3-[4-[ethyl-[2-(4-methylsulfonylphenyl)-1-oxoethyl]amino]-1-piperidinyl]-1-phenylpropyl]-5-propan-2-yl-2H-triazole-4-carboxamide hydrochloride IUPAC Name: N-[(1S)-3-[4-[ethyl-[2-(4-methylsulfonylphenyl)acetyl]amino]piperidin-1-yl]-1-phenylpropyl]-5-propan-2-yl-2H-triazole-4-carboxamide hydrochloride Traditional Name: N-[(1S)-3-[4-[ethyl-[2-(4-mesylphenyl)acetyl]amino]piperidino]-1-phenyl-propyl]-5-isopropyl-2H-triazole-4-carboxamide hydrochloride Formula: C31H43ClN6O4S MolecularWeight: 631.22892

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCN(CC1)CCC(C2=CC=CC=C2)NC(=O)C3=NNN=C3C(C)C)C(=O)CC4=CC=C(C=C4)S(=O)(=O)C.Cl

Isomeric SMILES

CCN(C1CCN(CC1)CC[C@@H](C2=CC=CC=C2)NC(=O)C3=NNN=C3C(C)C)C(=O)CC4=CC=C(C=C4)S(=O)(=O)C.Cl

InChI

InChI=1S/C31H42N6O4S.ClH/c1-5-37(28(38)21-23-11-13-26(14-12-23)42(4,40)41)25-15-18-36(19-16-25)20-17-27(24-9-7-6-8-10-24)32-31(39)30-29(22(2)3)33-35-34-30;/h6-14,22,25,27H,5,15-21H2,1-4H3,(H,32,39)(H,33,34,35);1H/t27-;/m0./s1