N-[2-oxidanylidene-4-[[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-7-yl]ethanamide

Systemtic Name: N-[2-oxidanylidene-4-[[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-7-yl]ethanamide Openeye Name: N-[2-oxo-4-[[5-[2-(2-thienyl)ethylamino]-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-7-yl]acetamide CAS Name: N-[2-oxo-4-[[[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]thio]methyl]-1-benzopyran-7-yl]acetamide IUPAC Name: N-[2-oxo-4-[[5-(2-thiophen-2-ylethylamino)-1,3,4-thiadiazol-2-yl]sulfanylmethyl]chromen-7-yl]acetamide Traditional Name: N-[2-keto-4-[[[5-[2-(2-thienyl)ethylamino]-1,3,4-thiadiazol-2-yl]thio]methyl]chromen-7-yl]acetamide Formula: C20H18N4O3S3 MolecularWeight: 458.57692

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NN=C(S3)NCCC4=CC=CS4

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NN=C(S3)NCCC4=CC=CS4

InChI

InChI=1S/C20H18N4O3S3/c1-12(25)22-14-4-5-16-13(9-18(26)27-17(16)10-14)11-29-20-24-23-19(30-20)21-7-6-15-3-2-8-28-15/h2-5,8-10H,6-7,11H2,1H3,(H,21,23)(H,22,25)