ethyl 4-[2-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]butanoate

Systemtic Name: ethyl 4-[2-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]butanoate Openeye Name: ethyl 4-[[2-[(4-cyclopropyl-5-isopropyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]butanoate CAS Name: 4-[[2-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(4-cyclopropyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]butanoate Traditional Name: 4-[[2-[(4-cyclopropyl-5-isopropyl-1,2,4-triazol-3-yl)thio]acetyl]amino]butyric acid ethyl ester Formula: C16H26N4O3S MolecularWeight: 354.46764

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCNC(=O)CSC1=NN=C(N1C2CC2)C(C)C

Isomeric SMILES

CCOC(=O)CCCNC(=O)CSC1=NN=C(N1C2CC2)C(C)C

InChI

InChI=1S/C16H26N4O3S/c1-4-23-14(22)6-5-9-17-13(21)10-24-16-19-18-15(11(2)3)20(16)12-7-8-12/h11-12H,4-10H2,1-3H3,(H,17,21)