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

Systemtic Name: 3-ethyl-4-oxidanylidene-N-[3-(4-phenylpiperazin-1-yl)propyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-ethyl-4-oxo-N-[3-(4-phenylpiperazin-1-yl)propyl]-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 3-ethyl-4-oxo-N-[3-(4-phenyl-1-piperazinyl)propyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 3-ethyl-4-oxo-N-[3-(4-phenylpiperazin-1-yl)propyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-ethyl-4-keto-N-[3-(4-phenylpiperazino)propyl]-2-thioxo-1H-quinazoline-7-carboxamide Formula: C24H29N5O2S MolecularWeight: 451.58436

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=C(C=C2)C(=O)NCCCN3CCN(CC3)C4=CC=CC=C4)NC1=S

Isomeric SMILES

CCN1C(=O)C2=C(C=C(C=C2)C(=O)NCCCN3CCN(CC3)C4=CC=CC=C4)NC1=S

InChI

InChI=1S/C24H29N5O2S/c1-2-29-23(31)20-10-9-18(17-21(20)26-24(29)32)22(30)25-11-6-12-27-13-15-28(16-14-27)19-7-4-3-5-8-19/h3-5,7-10,17H,2,6,11-16H2,1H3,(H,25,30)(H,26,32)