3-methyl-N-[4-[(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]-1,3-thiazol-2-yl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-methyl-N-[4-[(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]-1,3-thiazol-2-yl]-1-benzothiophene-2-carboxamide Openeye Name: N-[4-[(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)methyl]thiazol-2-yl]-3-methyl-benzothiophene-2-carboxamide CAS Name: 3-methyl-N-[4-[(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]-2-thiazolyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-methyl-N-[4-[(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]-1,3-thiazol-2-yl]-1-benzothiophene-2-carboxamide Traditional Name: N-[4-[(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)methyl]thiazol-2-yl]-3-methyl-benzothiophene-2-carboxamide Formula: C19H17N5OS3 MolecularWeight: 427.56618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C(=O)NC3=NC(=CS3)CC4=NNC(=S)N4CC=C

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C(=O)NC3=NC(=CS3)CC4=NNC(=S)N4CC=C

InChI

InChI=1S/C19H17N5OS3/c1-3-8-24-15(22-23-19(24)26)9-12-10-27-18(20-12)21-17(25)16-11(2)13-6-4-5-7-14(13)28-16/h3-7,10H,1,8-9H2,2H3,(H,23,26)(H,20,21,25)