N-(3-methoxyphenyl)-3-(4-methoxyquinolin-2-yl)carbonyl-3,8-diazaspiro[4.5]decane-8-carbothioamide

Systemtic Name: N-(3-methoxyphenyl)-3-(4-methoxyquinolin-2-yl)carbonyl-3,8-diazaspiro[4.5]decane-8-carbothioamide Openeye Name: N-(3-methoxyphenyl)-3-(4-methoxyquinoline-2-carbonyl)-3,8-diazaspiro[4.5]decane-8-carbothioamide CAS Name: N-(3-methoxyphenyl)-3-[(4-methoxy-2-quinolinyl)-oxomethyl]-3,8-diazaspiro[4.5]decane-8-carbothioamide IUPAC Name: N-(3-methoxyphenyl)-3-(4-methoxyquinoline-2-carbonyl)-3,8-diazaspiro[4.5]decane-8-carbothioamide Traditional Name: N-(3-methoxyphenyl)-3-(4-methoxyquinoline-2-carbonyl)-3,8-diazaspiro[4.5]decane-8-carbothioamide Formula: C27H30N4O3S MolecularWeight: 490.6171

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)N2CCC3(CC2)CCN(C3)C(=O)C4=NC5=CC=CC=C5C(=C4)OC

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)N2CCC3(CC2)CCN(C3)C(=O)C4=NC5=CC=CC=C5C(=C4)OC

InChI

InChI=1S/C27H30N4O3S/c1-33-20-7-5-6-19(16-20)28-26(35)30-13-10-27(11-14-30)12-15-31(18-27)25(32)23-17-24(34-2)21-8-3-4-9-22(21)29-23/h3-9,16-17H,10-15,18H2,1-2H3,(H,28,35)