2-[3-cyclopropyl-5-[2-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-4-yl]ethanamide

Systemtic Name: 2-[3-cyclopropyl-5-[2-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazol-4-yl]ethanamide Openeye Name: 2-[3-cyclopropyl-5-[2-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-oxo-ethyl]sulfanyl-1,2,4-triazol-4-yl]acetamide CAS Name: 2-[3-cyclopropyl-5-[[2-(1-cyclopropyl-2,5-dimethyl-3-pyrrolyl)-2-oxoethyl]thio]-1,2,4-triazol-4-yl]acetamide IUPAC Name: 2-[3-cyclopropyl-5-[2-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-2-oxoethyl]sulfanyl-1,2,4-triazol-4-yl]acetamide Traditional Name: 2-[3-cyclopropyl-5-[[2-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-keto-ethyl]thio]-1,2,4-triazol-4-yl]acetamide Formula: C18H23N5O2S MolecularWeight: 373.47252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CC2)C)C(=O)CSC3=NN=C(N3CC(=O)N)C4CC4

Isomeric SMILES

CC1=CC(=C(N1C2CC2)C)C(=O)CSC3=NN=C(N3CC(=O)N)C4CC4

InChI

InChI=1S/C18H23N5O2S/c1-10-7-14(11(2)23(10)13-5-6-13)15(24)9-26-18-21-20-17(12-3-4-12)22(18)8-16(19)25/h7,12-13H,3-6,8-9H2,1-2H3,(H2,19,25)