N-[[(3R)-1,1-bis(oxidanylidene)thiolan-3-yl]methyl]-1-(4-methyl-6-propan-2-yl-quinazolin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-[[(3R)-1,1-bis(oxidanylidene)thiolan-3-yl]methyl]-1-(4-methyl-6-propan-2-yl-quinazolin-2-yl)piperidine-4-carboxamide Openeye Name: N-[[(3R)-1,1-dioxothiolan-3-yl]methyl]-1-(6-isopropyl-4-methyl-quinazolin-2-yl)piperidine-4-carboxamide CAS Name: N-[[(3R)-1,1-dioxo-3-thiolanyl]methyl]-1-(4-methyl-6-propan-2-yl-2-quinazolinyl)-4-piperidinecarboxamide IUPAC Name: N-[[(3R)-1,1-dioxothiolan-3-yl]methyl]-1-(4-methyl-6-propan-2-ylquinazolin-2-yl)piperidine-4-carboxamide Traditional Name: N-[[(3R)-1,1-diketothiolan-3-yl]methyl]-1-(6-isopropyl-4-methyl-quinazolin-2-yl)isonipecotamide Formula: C23H32N4O3S MolecularWeight: 444.59018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1C=C(C=C2)C(C)C)N3CCC(CC3)C(=O)NCC4CCS(=O)(=O)C4

Isomeric SMILES

CC1=NC(=NC2=C1C=C(C=C2)C(C)C)N3CCC(CC3)C(=O)NC[C@H]4CCS(=O)(=O)C4

InChI

InChI=1S/C23H32N4O3S/c1-15(2)19-4-5-21-20(12-19)16(3)25-23(26-21)27-9-6-18(7-10-27)22(28)24-13-17-8-11-31(29,30)14-17/h4-5,12,15,17-18H,6-11,13-14H2,1-3H3,(H,24,28)/t17-/m1/s1