N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-[[5-(2-chlorophenyl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-[[5-(2-chlorophenyl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[4-benzyl-5-(2-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(1,1-dioxothiolan-3-yl)acetamide CAS Name: 2-[[5-(2-chlorophenyl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]-N-(1,1-dioxo-3-thiolanyl)acetamide IUPAC Name: 2-[[4-benzyl-5-(2-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(1,1-dioxothiolan-3-yl)acetamide Traditional Name: 2-[[4-benzyl-5-(2-chlorophenyl)-1,2,4-triazol-3-yl]thio]-N-(1,1-diketothiolan-3-yl)acetamide Formula: C21H21ClN4O3S2 MolecularWeight: 476.99944

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1NC(=O)CSC2=NN=C(N2CC3=CC=CC=C3)C4=CC=CC=C4Cl

Isomeric SMILES

C1CS(=O)(=O)CC1NC(=O)CSC2=NN=C(N2CC3=CC=CC=C3)C4=CC=CC=C4Cl

InChI

InChI=1S/C21H21ClN4O3S2/c22-18-9-5-4-8-17(18)20-24-25-21(26(20)12-15-6-2-1-3-7-15)30-13-19(27)23-16-10-11-31(28,29)14-16/h1-9,16H,10-14H2,(H,23,27)