ethyl 4-[2-(2-methylquinazolin-4-yl)sulfanylethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-(2-methylquinazolin-4-yl)sulfanylethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-(2-methylquinazolin-4-yl)sulfanylacetyl]piperazine-1-carboxylate CAS Name: 4-[2-[(2-methyl-4-quinazolinyl)thio]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(2-methylquinazolin-4-yl)sulfanylacetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[(2-methylquinazolin-4-yl)thio]acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C18H22N4O3S MolecularWeight: 374.45728

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CSC2=NC(=NC3=CC=CC=C32)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CSC2=NC(=NC3=CC=CC=C32)C

InChI

InChI=1S/C18H22N4O3S/c1-3-25-18(24)22-10-8-21(9-11-22)16(23)12-26-17-14-6-4-5-7-15(14)19-13(2)20-17/h4-7H,3,8-12H2,1-2H3