1-ethyl-N-(4-methyl-3-morpholin-4-ylcarbonyl-5-phenyl-thiophen-2-yl)benzotriazole-5-carboxamide

Systemtic Name: 1-ethyl-N-(4-methyl-3-morpholin-4-ylcarbonyl-5-phenyl-thiophen-2-yl)benzotriazole-5-carboxamide Openeye Name: 1-ethyl-N-[4-methyl-3-(morpholine-4-carbonyl)-5-phenyl-2-thienyl]benzotriazole-5-carboxamide CAS Name: 1-ethyl-N-[4-methyl-3-[4-morpholinyl(oxo)methyl]-5-phenyl-2-thiophenyl]-5-benzotriazolecarboxamide IUPAC Name: 1-ethyl-N-[4-methyl-3-(morpholine-4-carbonyl)-5-phenylthiophen-2-yl]benzotriazole-5-carboxamide Traditional Name: 1-ethyl-N-[4-methyl-3-(morpholine-4-carbonyl)-5-phenyl-2-thienyl]benzotriazole-5-carboxamide Formula: C25H25N5O3S MolecularWeight: 475.5627

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)NC3=C(C(=C(S3)C4=CC=CC=C4)C)C(=O)N5CCOCC5)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)NC3=C(C(=C(S3)C4=CC=CC=C4)C)C(=O)N5CCOCC5)N=N1

InChI

InChI=1S/C25H25N5O3S/c1-3-30-20-10-9-18(15-19(20)27-28-30)23(31)26-24-21(25(32)29-11-13-33-14-12-29)16(2)22(34-24)17-7-5-4-6-8-17/h4-10,15H,3,11-14H2,1-2H3,(H,26,31)