3-methoxy-N-[(2-phenylbenzotriazol-5-yl)carbamothioyl]naphthalene-2-carboxamide

Systemtic Name: 3-methoxy-N-[(2-phenylbenzotriazol-5-yl)carbamothioyl]naphthalene-2-carboxamide Openeye Name: 3-methoxy-N-[(2-phenylbenzotriazol-5-yl)carbamothioyl]naphthalene-2-carboxamide CAS Name: 3-methoxy-N-[[(2-phenyl-5-benzotriazolyl)amino]-sulfanylidenemethyl]-2-naphthalenecarboxamide IUPAC Name: 3-methoxy-N-[(2-phenylbenzotriazol-5-yl)carbamothioyl]naphthalene-2-carboxamide Traditional Name: 3-methoxy-N-[(2-phenylbenzotriazol-5-yl)thiocarbamoyl]-2-naphthamide Formula: C25H19N5O2S MolecularWeight: 453.51566

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC=CC=C2C=C1C(=O)NC(=S)NC3=CC4=NN(N=C4C=C3)C5=CC=CC=C5

Isomeric SMILES

COC1=CC2=CC=CC=C2C=C1C(=O)NC(=S)NC3=CC4=NN(N=C4C=C3)C5=CC=CC=C5

InChI

InChI=1S/C25H19N5O2S/c1-32-23-14-17-8-6-5-7-16(17)13-20(23)24(31)27-25(33)26-18-11-12-21-22(15-18)29-30(28-21)19-9-3-2-4-10-19/h2-15H,1H3,(H2,26,27,31,33)