N-[[2-(4-ethoxyphenyl)benzotriazol-5-yl]carbamothioyl]propanamide

Systemtic Name: N-[[2-(4-ethoxyphenyl)benzotriazol-5-yl]carbamothioyl]propanamide Openeye Name: N-[[2-(4-ethoxyphenyl)benzotriazol-5-yl]carbamothioyl]propanamide CAS Name: N-[[[2-(4-ethoxyphenyl)-5-benzotriazolyl]amino]-sulfanylidenemethyl]propanamide IUPAC Name: N-[[2-(4-ethoxyphenyl)benzotriazol-5-yl]carbamothioyl]propanamide Traditional Name: N-[(2-p-phenetylbenzotriazol-5-yl)thiocarbamoyl]propionamide Formula: C18H19N5O2S MolecularWeight: 369.44076

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(=S)NC1=CC2=NN(N=C2C=C1)C3=CC=C(C=C3)OCC

Isomeric SMILES

CCC(=O)NC(=S)NC1=CC2=NN(N=C2C=C1)C3=CC=C(C=C3)OCC

InChI

InChI=1S/C18H19N5O2S/c1-3-17(24)20-18(26)19-12-5-10-15-16(11-12)22-23(21-15)13-6-8-14(9-7-13)25-4-2/h5-11H,3-4H2,1-2H3,(H2,19,20,24,26)