3-ethyl-4-oxidanylidene-N-[1-(phenylmethyl)piperidin-4-yl]-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: 3-ethyl-4-oxidanylidene-N-[1-(phenylmethyl)piperidin-4-yl]-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-(1-benzyl-4-piperidyl)-3-ethyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 3-ethyl-4-oxo-N-[1-(phenylmethyl)-4-piperidinyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-3-ethyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-(1-benzyl-4-piperidyl)-3-ethyl-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=C(C=C2)C(=O)NC3CCN(CC3)CC4=CC=CC=C4)NC1=S

Isomeric SMILES

CCN1C(=O)C2=C(C=C(C=C2)C(=O)NC3CCN(CC3)CC4=CC=CC=C4)NC1=S

InChI

InChI=1S/C23H26N4O2S/c1-2-27-22(29)19-9-8-17(14-20(19)25-23(27)30)21(28)24-18-10-12-26(13-11-18)15-16-6-4-3-5-7-16/h3-9,14,18H,2,10-13,15H2,1H3,(H,24,28)(H,25,30)