methyl 3-[2-[(2S)-3-oxidanylidene-1-(phenylcarbamoyl)piperazin-2-yl]ethanoylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[2-[(2S)-3-oxidanylidene-1-(phenylcarbamoyl)piperazin-2-yl]ethanoylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[2-[(2S)-3-oxo-1-(phenylcarbamoyl)piperazin-2-yl]acetyl]amino]thiophene-2-carboxylate CAS Name: 3-[[2-[(2S)-1-[anilino(oxo)methyl]-3-oxo-2-piperazinyl]-1-oxoethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[2-[(2S)-3-oxo-1-(phenylcarbamoyl)piperazin-2-yl]acetyl]amino]thiophene-2-carboxylate Traditional Name: 3-[[2-[(2S)-3-keto-1-(phenylcarbamoyl)piperazin-2-yl]acetyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C19H20N4O5S MolecularWeight: 416.4509

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=O)CC2C(=O)NCCN2C(=O)NC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=O)C[C@H]2C(=O)NCCN2C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C19H20N4O5S/c1-28-18(26)16-13(7-10-29-16)22-15(24)11-14-17(25)20-8-9-23(14)19(27)21-12-5-3-2-4-6-12/h2-7,10,14H,8-9,11H2,1H3,(H,20,25)(H,21,27)(H,22,24)/t14-/m0/s1