1-(2,3-diphenyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-8-yl)-2-thiophen-2-yl-ethanone

Systemtic Name: 1-(2,3-diphenyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-8-yl)-2-thiophen-2-yl-ethanone Openeye Name: 1-(2,3-diphenyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-8-yl)-2-(2-thienyl)ethanone CAS Name: 1-(2,3-diphenyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-8-yl)-2-thiophen-2-ylethanone IUPAC Name: 1-(2,3-diphenyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-8-yl)-2-thiophen-2-ylethanone Traditional Name: 1-(2,3-diphenyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-8-yl)-2-(2-thienyl)ethanone Formula: C25H23N3OS MolecularWeight: 413.53462

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12N=C(C(=N2)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)CC5=CC=CS5

Isomeric SMILES

C1CN(CCC12N=C(C(=N2)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)CC5=CC=CS5

InChI

InChI=1S/C25H23N3OS/c29-22(18-21-12-7-17-30-21)28-15-13-25(14-16-28)26-23(19-8-3-1-4-9-19)24(27-25)20-10-5-2-6-11-20/h1-12,17H,13-16,18H2