N-[3-cyano-1-(furan-2-ylmethyl)-4,5-dimethyl-pyrrol-2-yl]-3-(1,3,4-thiadiazol-2-ylsulfanyl)propanamide

Systemtic Name: N-[3-cyano-1-(furan-2-ylmethyl)-4,5-dimethyl-pyrrol-2-yl]-3-(1,3,4-thiadiazol-2-ylsulfanyl)propanamide Openeye Name: N-[3-cyano-1-(2-furylmethyl)-4,5-dimethyl-pyrrol-2-yl]-3-(1,3,4-thiadiazol-2-ylsulfanyl)propanamide CAS Name: N-[3-cyano-1-(2-furanylmethyl)-4,5-dimethyl-2-pyrrolyl]-3-(1,3,4-thiadiazol-2-ylthio)propanamide IUPAC Name: N-[3-cyano-1-(furan-2-ylmethyl)-4,5-dimethylpyrrol-2-yl]-3-(1,3,4-thiadiazol-2-ylsulfanyl)propanamide Traditional Name: N-[3-cyano-1-(2-furfuryl)-4,5-dimethyl-pyrrol-2-yl]-3-(1,3,4-thiadiazol-2-ylthio)propionamide Formula: C17H17N5O2S2 MolecularWeight: 387.47918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)CCSC2=NN=CS2)CC3=CC=CO3)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)CCSC2=NN=CS2)CC3=CC=CO3)C

InChI

InChI=1S/C17H17N5O2S2/c1-11-12(2)22(9-13-4-3-6-24-13)16(14(11)8-18)20-15(23)5-7-25-17-21-19-10-26-17/h3-4,6,10H,5,7,9H2,1-2H3,(H,20,23)