3-[[5-(benzotriazol-1-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N,N-diphenyl-propanamide

Systemtic Name: 3-[[5-(benzotriazol-1-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N,N-diphenyl-propanamide Openeye Name: 3-[[5-(benzotriazol-1-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N,N-diphenyl-propanamide CAS Name: 3-[[5-(1-benzotriazolyl)-4-phenyl-1,2,4-triazol-3-yl]thio]-N,N-diphenylpropanamide IUPAC Name: 3-[[5-(benzotriazol-1-yl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N,N-diphenylpropanamide Traditional Name: 3-[[5-(benzotriazol-1-yl)-4-phenyl-1,2,4-triazol-3-yl]thio]-N,N-diphenyl-propionamide Formula: C29H23N7OS MolecularWeight: 517.60422

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2SCCC(=O)N(C3=CC=CC=C3)C4=CC=CC=C4)N5C6=CC=CC=C6N=N5

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2SCCC(=O)N(C3=CC=CC=C3)C4=CC=CC=C4)N5C6=CC=CC=C6N=N5

InChI

InChI=1S/C29H23N7OS/c37-27(34(22-12-4-1-5-13-22)23-14-6-2-7-15-23)20-21-38-29-32-31-28(35(29)24-16-8-3-9-17-24)36-26-19-11-10-18-25(26)30-33-36/h1-19H,20-21H2