N-[(4-butylphenyl)-thiophen-2-yl-methyl]-1-ethyl-benzotriazole-5-carboxamide

Systemtic Name: N-[(4-butylphenyl)-thiophen-2-yl-methyl]-1-ethyl-benzotriazole-5-carboxamide Openeye Name: N-[(4-butylphenyl)-(2-thienyl)methyl]-1-ethyl-benzotriazole-5-carboxamide CAS Name: N-[(4-butylphenyl)-thiophen-2-ylmethyl]-1-ethyl-5-benzotriazolecarboxamide IUPAC Name: N-[(4-butylphenyl)-thiophen-2-ylmethyl]-1-ethylbenzotriazole-5-carboxamide Traditional Name: N-[(4-butylphenyl)-(2-thienyl)methyl]-1-ethyl-benzotriazole-5-carboxamide Formula: C24H26N4OS MolecularWeight: 418.55444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3=CC4=C(C=C3)N(N=N4)CC

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3=CC4=C(C=C3)N(N=N4)CC

InChI

InChI=1S/C24H26N4OS/c1-3-5-7-17-9-11-18(12-10-17)23(22-8-6-15-30-22)25-24(29)19-13-14-21-20(16-19)26-27-28(21)4-2/h6,8-16,23H,3-5,7H2,1-2H3,(H,25,29)