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

Systemtic Name: 2-(4-oxidanylidene-3-prop-2-enyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-2-yl)sulfanyl-N,N-diphenyl-propanamide Openeye Name: 2-(3-allyl-4-oxo-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-2-yl)sulfanyl-N,N-diphenyl-propanamide CAS Name: 2-[(4-oxo-3-prop-2-enyl-2-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]yl)thio]-N,N-diphenylpropanamide IUPAC Name: 2-(4-oxo-3-prop-2-enylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-2-yl)sulfanyl-N,N-diphenylpropanamide Traditional Name: 2-[(3-allyl-4-keto-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-2-yl)thio]-N,N-diphenyl-propionamide Formula: C34H33N3O2S MolecularWeight: 547.70972

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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(CCCC5)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(CCCC5)CC6=CC=CC=C64

InChI

InChI=1S/C34H33N3O2S/c1-3-22-36-32(39)29-30(28-19-11-10-14-25(28)23-34(29)20-12-13-21-34)35-33(36)40-24(2)31(38)37(26-15-6-4-7-16-26)27-17-8-5-9-18-27/h3-11,14-19,24H,1,12-13,20-23H2,2H3