1-[6-(6-morpholin-4-yl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanoyl]-4-piperidin-1-yl-piperidine-4-carboxamide

Systemtic Name: 1-[6-(6-morpholin-4-yl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanoyl]-4-piperidin-1-yl-piperidine-4-carboxamide Openeye Name: 1-[6-(6-morpholino-4-oxo-2-thioxo-1H-quinazolin-3-yl)hexanoyl]-4-(1-piperidyl)piperidine-4-carboxamide CAS Name: 1-[6-[6-(4-morpholinyl)-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl]-1-oxohexyl]-4-(1-piperidinyl)-4-piperidinecarboxamide IUPAC Name: 1-[6-(6-morpholin-4-yl-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanoyl]-4-piperidin-1-ylpiperidine-4-carboxamide Traditional Name: 1-[6-(4-keto-6-morpholino-2-thioxo-1H-quinazolin-3-yl)hexanoyl]-4-piperidino-isonipecotamide Formula: C29H42N6O4S MolecularWeight: 570.74658

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2(CCN(CC2)C(=O)CCCCCN3C(=O)C4=C(C=CC(=C4)N5CCOCC5)NC3=S)C(=O)N

Isomeric SMILES

C1CCN(CC1)C2(CCN(CC2)C(=O)CCCCCN3C(=O)C4=C(C=CC(=C4)N5CCOCC5)NC3=S)C(=O)N

InChI

InChI=1S/C29H42N6O4S/c30-27(38)29(34-12-4-2-5-13-34)10-15-33(16-11-29)25(36)7-3-1-6-14-35-26(37)23-21-22(32-17-19-39-20-18-32)8-9-24(23)31-28(35)40/h8-9,21H,1-7,10-20H2,(H2,30,38)(H,31,40)