ethyl 5-[2-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanyl]butanoylamino]-4-cyano-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 5-[2-[(5-azanyl-1,3,4-thiadiazol-2-yl)sulfanyl]butanoylamino]-4-cyano-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]butanoylamino]-4-cyano-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[2-[(5-amino-1,3,4-thiadiazol-2-yl)thio]-1-oxobutyl]amino]-4-cyano-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]butanoylamino]-4-cyano-3-methylthiophene-2-carboxylate Traditional Name: 5-[2-[(5-amino-1,3,4-thiadiazol-2-yl)thio]butanoylamino]-4-cyano-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C15H17N5O3S3 MolecularWeight: 411.52218

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C(=C(S1)C(=O)OCC)C)C#N)SC2=NN=C(S2)N

Isomeric SMILES

CCC(C(=O)NC1=C(C(=C(S1)C(=O)OCC)C)C#N)SC2=NN=C(S2)N

InChI

InChI=1S/C15H17N5O3S3/c1-4-9(24-15-20-19-14(17)26-15)11(21)18-12-8(6-16)7(3)10(25-12)13(22)23-5-2/h9H,4-5H2,1-3H3,(H2,17,19)(H,18,21)