3-(2-diethylaminoethyl)-N-(2-methylcyclohexyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: 3-(2-diethylaminoethyl)-N-(2-methylcyclohexyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-(2-diethylaminoethyl)-N-(2-methylcyclohexyl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 3-(2-diethylaminoethyl)-N-(2-methylcyclohexyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 3-(2-diethylaminoethyl)-N-(2-methylcyclohexyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-(2-diethylaminoethyl)-4-keto-N-(2-methylcyclohexyl)-2-thioxo-1H-quinazoline-7-carboxamide Formula: C22H32N4O2S MolecularWeight: 416.58008

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C(=O)C2=C(C=C(C=C2)C(=O)NC3CCCCC3C)NC1=S

Isomeric SMILES

CCN(CC)CCN1C(=O)C2=C(C=C(C=C2)C(=O)NC3CCCCC3C)NC1=S

InChI

InChI=1S/C22H32N4O2S/c1-4-25(5-2)12-13-26-21(28)17-11-10-16(14-19(17)24-22(26)29)20(27)23-18-9-7-6-8-15(18)3/h10-11,14-15,18H,4-9,12-13H2,1-3H3,(H,23,27)(H,24,29)