methyl 2-azanyl-4-[4-(phenylmethyl)piperazin-1-yl]-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 2-azanyl-4-[4-(phenylmethyl)piperazin-1-yl]-1,3-thiazole-5-carboxylate Openeye Name: methyl 2-amino-4-(4-benzylpiperazin-1-yl)thiazole-5-carboxylate CAS Name: 2-amino-4-[4-(phenylmethyl)-1-piperazinyl]-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-amino-4-(4-benzylpiperazin-1-yl)-1,3-thiazole-5-carboxylate Traditional Name: 2-amino-4-(4-benzylpiperazino)thiazole-5-carboxylic acid methyl ester Formula: C16H20N4O2S MolecularWeight: 332.4206

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N=C(S1)N)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(N=C(S1)N)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C16H20N4O2S/c1-22-15(21)13-14(18-16(17)23-13)20-9-7-19(8-10-20)11-12-5-3-2-4-6-12/h2-6H,7-11H2,1H3,(H2,17,18)