2-(4-oxidanylidene-3-prop-2-enyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl)sulfanyl-N,N-diphenyl-propanamide

Systemtic Name: 2-(4-oxidanylidene-3-prop-2-enyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl)sulfanyl-N,N-diphenyl-propanamide Openeye Name: 2-(3-allyl-4-oxo-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl)sulfanyl-N,N-diphenyl-propanamide CAS Name: 2-[(4-oxo-3-prop-2-enyl-2-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]yl)thio]-N,N-diphenylpropanamide IUPAC Name: 2-(4-oxo-3-prop-2-enylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl)sulfanyl-N,N-diphenylpropanamide Traditional Name: 2-[(3-allyl-4-keto-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl)thio]-N,N-diphenyl-propionamide Formula: C35H35N3O2S MolecularWeight: 561.7363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C1=CC=CC=C1)C2=CC=CC=C2)SC3=NC4=C(C(=O)N3CC=C)C5(CCCCC5)CC6=CC=CC=C64

Isomeric SMILES

CC(C(=O)N(C1=CC=CC=C1)C2=CC=CC=C2)SC3=NC4=C(C(=O)N3CC=C)C5(CCCCC5)CC6=CC=CC=C64

InChI

InChI=1S/C35H35N3O2S/c1-3-23-37-33(40)30-31(29-20-12-11-15-26(29)24-35(30)21-13-6-14-22-35)36-34(37)41-25(2)32(39)38(27-16-7-4-8-17-27)28-18-9-5-10-19-28/h3-5,7-12,15-20,25H,1,6,13-14,21-24H2,2H3