N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2-[[5-[(4-methoxyphenyl)methyl]-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2-[[5-[(4-methoxyphenyl)methyl]-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2-[[4-isopropyl-5-[(4-methoxyphenyl)methyl]-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2-[[5-[(4-methoxyphenyl)methyl]-4-propan-2-yl-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2-[[5-[(4-methoxyphenyl)methyl]-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-2-[(4-isopropyl-5-p-anisyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C21H26N6O2S2 MolecularWeight: 458.60014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=NN=C1SC(C)C(=O)NC2=NN=C(S2)C3CC3)CC4=CC=C(C=C4)OC

Isomeric SMILES

CC(C)N1C(=NN=C1SC(C)C(=O)NC2=NN=C(S2)C3CC3)CC4=CC=C(C=C4)OC

InChI

InChI=1S/C21H26N6O2S2/c1-12(2)27-17(11-14-5-9-16(29-4)10-6-14)23-26-21(27)30-13(3)18(28)22-20-25-24-19(31-20)15-7-8-15/h5-6,9-10,12-13,15H,7-8,11H2,1-4H3,(H,22,25,28)