ethyl 2-[[5-[(8-ethoxy-2H-chromen-3-yl)carbonylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate

Systemtic Name: ethyl 2-[[5-[(8-ethoxy-2H-chromen-3-yl)carbonylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate Openeye Name: ethyl 2-[[5-[(8-ethoxy-2H-chromene-3-carbonyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-[[(8-ethoxy-2H-1-benzopyran-3-yl)-oxomethyl]amino]-1,3,4-thiadiazol-2-yl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[[5-[(8-ethoxy-2H-chromene-3-carbonyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-[(8-ethoxy-2H-chromene-3-carbonyl)amino]-1,3,4-thiadiazol-2-yl]thio]acetic acid ethyl ester Formula: C18H19N3O5S2 MolecularWeight: 421.49056

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC2=C1OCC(=C2)C(=O)NC3=NN=C(S3)SCC(=O)OCC

Isomeric SMILES

CCOC1=CC=CC2=C1OCC(=C2)C(=O)NC3=NN=C(S3)SCC(=O)OCC

InChI

InChI=1S/C18H19N3O5S2/c1-3-24-13-7-5-6-11-8-12(9-26-15(11)13)16(23)19-17-20-21-18(28-17)27-10-14(22)25-4-2/h5-8H,3-4,9-10H2,1-2H3,(H,19,20,23)