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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C(=O)C2=C(C=C(C=C2)C(=O)NC3CCCCCC3)NC1=S

Isomeric SMILES

CCN(CC)CCN1C(=O)C2=C(C=C(C=C2)C(=O)NC3CCCCCC3)NC1=S

InChI

InChI=1S/C22H32N4O2S/c1-3-25(4-2)13-14-26-21(28)18-12-11-16(15-19(18)24-22(26)29)20(27)23-17-9-7-5-6-8-10-17/h11-12,15,17H,3-10,13-14H2,1-2H3,(H,23,27)(H,24,29)