2-[2,4-bis(chloranyl)phenoxy]-N-[(2-naphthalen-1-ylbenzotriazol-5-yl)carbamothioyl]propanamide

Systemtic Name: 2-[2,4-bis(chloranyl)phenoxy]-N-[(2-naphthalen-1-ylbenzotriazol-5-yl)carbamothioyl]propanamide Openeye Name: 2-(2,4-dichlorophenoxy)-N-[[2-(1-naphthyl)benzotriazol-5-yl]carbamothioyl]propanamide CAS Name: 2-(2,4-dichlorophenoxy)-N-[[[2-(1-naphthalenyl)-5-benzotriazolyl]amino]-sulfanylidenemethyl]propanamide IUPAC Name: 2-(2,4-dichlorophenoxy)-N-[(2-naphthalen-1-ylbenzotriazol-5-yl)carbamothioyl]propanamide Traditional Name: 2-(2,4-dichlorophenoxy)-N-[[2-(1-naphthyl)benzotriazol-5-yl]thiocarbamoyl]propionamide Formula: C26H19Cl2N5O2S MolecularWeight: 536.43236

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=S)NC1=CC2=NN(N=C2C=C1)C3=CC=CC4=CC=CC=C43)OC5=C(C=C(C=C5)Cl)Cl

Isomeric SMILES

CC(C(=O)NC(=S)NC1=CC2=NN(N=C2C=C1)C3=CC=CC4=CC=CC=C43)OC5=C(C=C(C=C5)Cl)Cl

InChI

InChI=1S/C26H19Cl2N5O2S/c1-15(35-24-12-9-17(27)13-20(24)28)25(34)30-26(36)29-18-10-11-21-22(14-18)32-33(31-21)23-8-4-6-16-5-2-3-7-19(16)23/h2-15H,1H3,(H2,29,30,34,36)