3-(3-methoxypropyl)-N-methyl-4-oxidanylidene-N-[(2-piperidin-1-ylphenyl)methyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: 3-(3-methoxypropyl)-N-methyl-4-oxidanylidene-N-[(2-piperidin-1-ylphenyl)methyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-(3-methoxypropyl)-N-methyl-4-oxo-N-[[2-(1-piperidyl)phenyl]methyl]-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 3-(3-methoxypropyl)-N-methyl-4-oxo-N-[[2-(1-piperidinyl)phenyl]methyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 3-(3-methoxypropyl)-N-methyl-4-oxo-N-[(2-piperidin-1-ylphenyl)methyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 4-keto-3-(3-methoxypropyl)-N-methyl-N-(2-piperidinobenzyl)-2-thioxo-1H-quinazoline-7-carboxamide Formula: C26H32N4O3S MolecularWeight: 480.62228

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1N2CCCCC2)C(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)CCCOC

Isomeric SMILES

CN(CC1=CC=CC=C1N2CCCCC2)C(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)CCCOC

InChI

InChI=1S/C26H32N4O3S/c1-28(18-20-9-4-5-10-23(20)29-13-6-3-7-14-29)24(31)19-11-12-21-22(17-19)27-26(34)30(25(21)32)15-8-16-33-2/h4-5,9-12,17H,3,6-8,13-16,18H2,1-2H3,(H,27,34)