3-(4-oxidanylidene-6-phenyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylpropanamide

Systemtic Name: 3-(4-oxidanylidene-6-phenyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylpropanamide Openeye Name: 3-(3-allyl-4-oxo-6-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylpropanamide CAS Name: 3-[(4-oxo-6-phenyl-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl)thio]propanamide IUPAC Name: 3-(4-oxo-6-phenyl-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl)sulfanylpropanamide Traditional Name: 3-[(3-allyl-4-keto-6-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]propionamide Formula: C18H17N3O2S2 MolecularWeight: 371.47648

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(N=C1SCCC(=O)N)SC(=C2)C3=CC=CC=C3

Isomeric SMILES

C=CCN1C(=O)C2=C(N=C1SCCC(=O)N)SC(=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H17N3O2S2/c1-2-9-21-17(23)13-11-14(12-6-4-3-5-7-12)25-16(13)20-18(21)24-10-8-15(19)22/h2-7,11H,1,8-10H2,(H2,19,22)