4-butan-2-yloxy-N-[[2-(4-butylphenyl)benzotriazol-5-yl]carbamothioyl]benzamide

Systemtic Name: 4-butan-2-yloxy-N-[[2-(4-butylphenyl)benzotriazol-5-yl]carbamothioyl]benzamide Openeye Name: N-[[2-(4-butylphenyl)benzotriazol-5-yl]carbamothioyl]-4-sec-butoxy-benzamide CAS Name: 4-butan-2-yloxy-N-[[[2-(4-butylphenyl)-5-benzotriazolyl]amino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-butan-2-yloxy-N-[[2-(4-butylphenyl)benzotriazol-5-yl]carbamothioyl]benzamide Traditional Name: N-[[2-(4-butylphenyl)benzotriazol-5-yl]thiocarbamoyl]-4-sec-butoxy-benzamide Formula: C28H31N5O2S MolecularWeight: 501.64304

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=S)NC(=O)C4=CC=C(C=C4)OC(C)CC

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=S)NC(=O)C4=CC=C(C=C4)OC(C)CC

InChI

InChI=1S/C28H31N5O2S/c1-4-6-7-20-8-13-23(14-9-20)33-31-25-17-12-22(18-26(25)32-33)29-28(36)30-27(34)21-10-15-24(16-11-21)35-19(3)5-2/h8-19H,4-7H2,1-3H3,(H2,29,30,34,36)