N-[2-(diethylamino)-2-thiophen-3-yl-ethyl]-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide

Systemtic Name: N-[2-(diethylamino)-2-thiophen-3-yl-ethyl]-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Openeye Name: N-[2-(diethylamino)-2-(3-thienyl)ethyl]-3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanamide CAS Name: N-[2-(diethylamino)-2-(3-thiophenyl)ethyl]-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide IUPAC Name: N-[2-(diethylamino)-2-thiophen-3-ylethyl]-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Traditional Name: N-[2-(diethylamino)-2-(3-thienyl)ethyl]-3-(4-keto-2-thioxo-1H-quinazolin-3-yl)propionamide Formula: C21H26N4O2S2 MolecularWeight: 430.58674

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CNC(=O)CCN1C(=O)C2=CC=CC=C2NC1=S)C3=CSC=C3

Isomeric SMILES

CCN(CC)C(CNC(=O)CCN1C(=O)C2=CC=CC=C2NC1=S)C3=CSC=C3

InChI

InChI=1S/C21H26N4O2S2/c1-3-24(4-2)18(15-10-12-29-14-15)13-22-19(26)9-11-25-20(27)16-7-5-6-8-17(16)23-21(25)28/h5-8,10,12,14,18H,3-4,9,11,13H2,1-2H3,(H,22,26)(H,23,28)