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

Systemtic Name: 3-butyl-2-(2-oxidanylidene-2-thiophen-2-yl-ethyl)sulfanyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one Openeye Name: 3-butyl-2-[2-oxo-2-(2-thienyl)ethyl]sulfanyl-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one CAS Name: 3-butyl-2-[(2-oxo-2-thiophen-2-ylethyl)thio]-4-spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]one IUPAC Name: 3-butyl-2-(2-oxo-2-thiophen-2-ylethyl)sulfanylspiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one Traditional Name: 3-butyl-2-[[2-keto-2-(2-thienyl)ethyl]thio]spiro[6H-benzo[h]quinazoline-5,1'-cyclohexane]-4-one Formula: C27H30N2O2S2 MolecularWeight: 478.6693

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC(=O)C5=CC=CS5

Isomeric SMILES

CCCCN1C(=O)C2=C(C3=CC=CC=C3CC24CCCCC4)N=C1SCC(=O)C5=CC=CS5

InChI

InChI=1S/C27H30N2O2S2/c1-2-3-15-29-25(31)23-24(28-26(29)33-18-21(30)22-12-9-16-32-22)20-11-6-5-10-19(20)17-27(23)13-7-4-8-14-27/h5-6,9-12,16H,2-4,7-8,13-15,17-18H2,1H3