N-(3-chlorophenyl)-2-[4-oxidanylidene-3-(phenylmethyl)spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(3-chlorophenyl)-2-[4-oxidanylidene-3-(phenylmethyl)spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl]sulfanyl-ethanamide Openeye Name: 2-(3-benzyl-4-oxo-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl)sulfanyl-N-(3-chlorophenyl)acetamide CAS Name: N-(3-chlorophenyl)-2-[[4-oxo-3-(phenylmethyl)-2-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]yl]thio]acetamide IUPAC Name: 2-(3-benzyl-4-oxospiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl)sulfanyl-N-(3-chlorophenyl)acetamide Traditional Name: 2-[(3-benzyl-4-keto-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-2-yl)thio]-N-(3-chlorophenyl)acetamide Formula: C32H30ClN3O2S MolecularWeight: 556.1175

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)CC3=CC=CC=C3C4=C2C(=O)N(C(=N4)SCC(=O)NC5=CC(=CC=C5)Cl)CC6=CC=CC=C6

Isomeric SMILES

C1CCC2(CC1)CC3=CC=CC=C3C4=C2C(=O)N(C(=N4)SCC(=O)NC5=CC(=CC=C5)Cl)CC6=CC=CC=C6

InChI

InChI=1S/C32H30ClN3O2S/c33-24-13-9-14-25(18-24)34-27(37)21-39-31-35-29-26-15-6-5-12-23(26)19-32(16-7-2-8-17-32)28(29)30(38)36(31)20-22-10-3-1-4-11-22/h1,3-6,9-15,18H,2,7-8,16-17,19-21H2,(H,34,37)