methyl 4-methyl-5-[(3S)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-3-sulfanyl-butyl]thiophene-2-carboxylate

Systemtic Name: methyl 4-methyl-5-[(3S)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-3-sulfanyl-butyl]thiophene-2-carboxylate Openeye Name: methyl 5-[(3S)-4-(tert-butoxycarbonylamino)-3-sulfanyl-butyl]-4-methyl-thiophene-2-carboxylate CAS Name: 5-[(3S)-3-mercapto-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butyl]-4-methyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-methyl-5-[(3S)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-3-sulfanylbutyl]thiophene-2-carboxylate Traditional Name: 5-[(3S)-4-(tert-butoxycarbonylamino)-3-mercapto-butyl]-4-methyl-thiophene-2-carboxylic acid methyl ester Formula: C16H25NO4S2 MolecularWeight: 359.504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)C(=O)OC)CCC(CNC(=O)OC(C)(C)C)S

Isomeric SMILES

CC1=C(SC(=C1)C(=O)OC)CC[C@@H](CNC(=O)OC(C)(C)C)S

InChI

InChI=1S/C16H25NO4S2/c1-10-8-13(14(18)20-5)23-12(10)7-6-11(22)9-17-15(19)21-16(2,3)4/h8,11,22H,6-7,9H2,1-5H3,(H,17,19)/t11-/m0/s1