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

Systemtic Name: N,3-bis(2-diethylaminoethyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N,3-bis(2-diethylaminoethyl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N,3-bis(2-diethylaminoethyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N,3-bis(2-diethylaminoethyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N,3-bis(2-diethylaminoethyl)-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C21H33N5O2S MolecularWeight: 419.58402

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CCN(CC)CC

Isomeric SMILES

CCN(CC)CCNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CCN(CC)CC

InChI

InChI=1S/C21H33N5O2S/c1-5-24(6-2)12-11-22-19(27)16-9-10-17-18(15-16)23-21(29)26(20(17)28)14-13-25(7-3)8-4/h9-10,15H,5-8,11-14H2,1-4H3,(H,22,27)(H,23,29)