N-[(6-methyl-2-naphthalen-1-yl-benzotriazol-5-yl)carbamothioyl]propanamide

Systemtic Name: N-[(6-methyl-2-naphthalen-1-yl-benzotriazol-5-yl)carbamothioyl]propanamide Openeye Name: N-[[6-methyl-2-(1-naphthyl)benzotriazol-5-yl]carbamothioyl]propanamide CAS Name: N-[[[6-methyl-2-(1-naphthalenyl)-5-benzotriazolyl]amino]-sulfanylidenemethyl]propanamide IUPAC Name: N-[(6-methyl-2-naphthalen-1-ylbenzotriazol-5-yl)carbamothioyl]propanamide Traditional Name: N-[[6-methyl-2-(1-naphthyl)benzotriazol-5-yl]thiocarbamoyl]propionamide Formula: C21H19N5OS MolecularWeight: 389.47346

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(=S)NC1=CC2=NN(N=C2C=C1C)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCC(=O)NC(=S)NC1=CC2=NN(N=C2C=C1C)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C21H19N5OS/c1-3-20(27)23-21(28)22-16-12-18-17(11-13(16)2)24-26(25-18)19-10-6-8-14-7-4-5-9-15(14)19/h4-12H,3H2,1-2H3,(H2,22,23,27,28)