N-(6-ethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-(6-ethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-allyl-N-(6-ethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-(6-ethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(6-ethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-allyl-N-(6-ethyl-4-keto-thieno[2,3-d]pyrimidin-3-yl)-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C20H17N5O3S2 MolecularWeight: 439.51068

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=CN(C2=O)NC(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)CC=C

Isomeric SMILES

CCC1=CC2=C(S1)N=CN(C2=O)NC(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)CC=C

InChI

InChI=1S/C20H17N5O3S2/c1-3-7-24-18(27)13-6-5-11(8-15(13)22-20(24)29)16(26)23-25-10-21-17-14(19(25)28)9-12(4-2)30-17/h3,5-6,8-10H,1,4,7H2,2H3,(H,22,29)(H,23,26)