2-(2-oxidanylidene-2-thiophen-2-yl-ethyl)sulfanyl-3-phenethyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one

Systemtic Name: 2-(2-oxidanylidene-2-thiophen-2-yl-ethyl)sulfanyl-3-phenethyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one Openeye Name: 2-[2-oxo-2-(2-thienyl)ethyl]sulfanyl-3-phenethyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one CAS Name: 2-[(2-oxo-2-thiophen-2-ylethyl)thio]-3-phenethyl-4-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]one IUPAC Name: 2-(2-oxo-2-thiophen-2-ylethyl)sulfanyl-3-phenethylspiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one Traditional Name: 2-[[2-keto-2-(2-thienyl)ethyl]thio]-3-phenethyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclopentane]-4-one Formula: C30H28N2O2S2 MolecularWeight: 512.68552

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)CC3=CC=CC=C3C4=C2C(=O)N(C(=N4)SCC(=O)C5=CC=CS5)CCC6=CC=CC=C6

Isomeric SMILES

C1CCC2(C1)CC3=CC=CC=C3C4=C2C(=O)N(C(=N4)SCC(=O)C5=CC=CS5)CCC6=CC=CC=C6

InChI

InChI=1S/C30H28N2O2S2/c33-24(25-13-8-18-35-25)20-36-29-31-27-23-12-5-4-11-22(23)19-30(15-6-7-16-30)26(27)28(34)32(29)17-14-21-9-2-1-3-10-21/h1-5,8-13,18H,6-7,14-17,19-20H2