methyl 3-[2-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]ethanoylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[2-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]ethanoylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[2-[4-[(3-methylisoxazol-5-yl)methyl]piperazin-1-yl]acetyl]amino]thiophene-2-carboxylate CAS Name: 3-[[2-[4-[(3-methyl-5-isoxazolyl)methyl]-1-piperazinyl]-1-oxoethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[2-[4-[(3-methyl-1,2-oxazol-5-yl)methyl]piperazin-1-yl]acetyl]amino]thiophene-2-carboxylate Traditional Name: 3-[[2-[4-[(3-methylisoxazol-5-yl)methyl]piperazino]acetyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C17H22N4O4S MolecularWeight: 378.44598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)CN2CCN(CC2)CC(=O)NC3=C(SC=C3)C(=O)OC

Isomeric SMILES

CC1=NOC(=C1)CN2CCN(CC2)CC(=O)NC3=C(SC=C3)C(=O)OC

InChI

InChI=1S/C17H22N4O4S/c1-12-9-13(25-19-12)10-20-4-6-21(7-5-20)11-15(22)18-14-3-8-26-16(14)17(23)24-2/h3,8-9H,4-7,10-11H2,1-2H3,(H,18,22)