N-[3-(4-ethylpiperazin-1-yl)propyl]-4-[(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)methyl]cyclohexane-1-carboxamide

Systemtic Name: N-[3-(4-ethylpiperazin-1-yl)propyl]-4-[(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)methyl]cyclohexane-1-carboxamide Openeye Name: N-[3-(4-ethylpiperazin-1-yl)propyl]-4-[(4-oxo-2-thioxo-1H-quinazolin-3-yl)methyl]cyclohexanecarboxamide CAS Name: N-[3-(4-ethyl-1-piperazinyl)propyl]-4-[(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)methyl]-1-cyclohexanecarboxamide IUPAC Name: N-[3-(4-ethylpiperazin-1-yl)propyl]-4-[(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)methyl]cyclohexane-1-carboxamide Traditional Name: N-[3-(4-ethylpiperazino)propyl]-4-[(4-keto-2-thioxo-1H-quinazolin-3-yl)methyl]cyclohexanecarboxamide Formula: C25H37N5O2S MolecularWeight: 471.65858

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CCCNC(=O)C2CCC(CC2)CN3C(=O)C4=CC=CC=C4NC3=S

Isomeric SMILES

CCN1CCN(CC1)CCCNC(=O)C2CCC(CC2)CN3C(=O)C4=CC=CC=C4NC3=S

InChI

InChI=1S/C25H37N5O2S/c1-2-28-14-16-29(17-15-28)13-5-12-26-23(31)20-10-8-19(9-11-20)18-30-24(32)21-6-3-4-7-22(21)27-25(30)33/h3-4,6-7,19-20H,2,5,8-18H2,1H3,(H,26,31)(H,27,33)