3-(methoxymethyl)-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)-1-benzofuran-2-carboxamide

Systemtic Name: 3-(methoxymethyl)-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)-1-benzofuran-2-carboxamide Openeye Name: N-(5-allylsulfanyl-1,3,4-thiadiazol-2-yl)-3-(methoxymethyl)benzofuran-2-carboxamide CAS Name: 3-(methoxymethyl)-N-[5-(prop-2-enylthio)-1,3,4-thiadiazol-2-yl]-2-benzofurancarboxamide IUPAC Name: 3-(methoxymethyl)-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)-1-benzofuran-2-carboxamide Traditional Name: N-[5-(allylthio)-1,3,4-thiadiazol-2-yl]-3-(methoxymethyl)coumarilamide Formula: C16H15N3O3S2 MolecularWeight: 361.4386

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C(OC2=CC=CC=C21)C(=O)NC3=NN=C(S3)SCC=C

Isomeric SMILES

COCC1=C(OC2=CC=CC=C21)C(=O)NC3=NN=C(S3)SCC=C

InChI

InChI=1S/C16H15N3O3S2/c1-3-8-23-16-19-18-15(24-16)17-14(20)13-11(9-21-2)10-6-4-5-7-12(10)22-13/h3-7H,1,8-9H2,2H3,(H,17,18,20)