(1-butyl-1,2,3,4-tetrazol-5-yl)methyl 5-(furan-2-ylcarbonylamino)-3-methyl-thiophene-2-carboxylate

Systemtic Name: (1-butyl-1,2,3,4-tetrazol-5-yl)methyl 5-(furan-2-ylcarbonylamino)-3-methyl-thiophene-2-carboxylate Openeye Name: (1-butyltetrazol-5-yl)methyl 5-(furan-2-carbonylamino)-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[2-furanyl(oxo)methyl]amino]-3-methyl-2-thiophenecarboxylic acid (1-butyl-5-tetrazolyl)methyl ester IUPAC Name: (1-butyltetrazol-5-yl)methyl 5-(furan-2-carbonylamino)-3-methylthiophene-2-carboxylate Traditional Name: 5-(2-furoylamino)-3-methyl-thiophene-2-carboxylic acid (1-butyltetrazol-5-yl)methyl ester Formula: C17H19N5O4S MolecularWeight: 389.42886

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=N1)COC(=O)C2=C(C=C(S2)NC(=O)C3=CC=CO3)C

Isomeric SMILES

CCCCN1C(=NN=N1)COC(=O)C2=C(C=C(S2)NC(=O)C3=CC=CO3)C

InChI

InChI=1S/C17H19N5O4S/c1-3-4-7-22-13(19-20-21-22)10-26-17(24)15-11(2)9-14(27-15)18-16(23)12-6-5-8-25-12/h5-6,8-9H,3-4,7,10H2,1-2H3,(H,18,23)