propan-2-yl 4-[[5-(5-ethanoylthiophen-2-yl)pyrazin-2-yl]methyl-methyl-amino]piperidine-1-carboxylate

Systemtic Name: propan-2-yl 4-[[5-(5-ethanoylthiophen-2-yl)pyrazin-2-yl]methyl-methyl-amino]piperidine-1-carboxylate Openeye Name: isopropyl 4-[[5-(5-acetyl-2-thienyl)pyrazin-2-yl]methyl-methyl-amino]piperidine-1-carboxylate CAS Name: 4-[[5-(5-acetyl-2-thiophenyl)-2-pyrazinyl]methyl-methylamino]-1-piperidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[5-(5-acetylthiophen-2-yl)pyrazin-2-yl]methyl-methylamino]piperidine-1-carboxylate Traditional Name: 4-[[5-(5-acetyl-2-thienyl)pyrazin-2-yl]methyl-methyl-amino]piperidine-1-carboxylic acid isopropyl ester Formula: C21H28N4O3S MolecularWeight: 416.53702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)N1CCC(CC1)N(C)CC2=NC=C(N=C2)C3=CC=C(S3)C(=O)C

Isomeric SMILES

CC(C)OC(=O)N1CCC(CC1)N(C)CC2=NC=C(N=C2)C3=CC=C(S3)C(=O)C

InChI

InChI=1S/C21H28N4O3S/c1-14(2)28-21(27)25-9-7-17(8-10-25)24(4)13-16-11-23-18(12-22-16)20-6-5-19(29-20)15(3)26/h5-6,11-12,14,17H,7-10,13H2,1-4H3