(2S)-N-(ethylcarbamoyl)-2-(4-oxidanylidene-6-phenyl-3-prop-2-enyl-thieno[3,2-d]pyrimidin-2-yl)sulfanyl-propanamide

Systemtic Name: (2S)-N-(ethylcarbamoyl)-2-(4-oxidanylidene-6-phenyl-3-prop-2-enyl-thieno[3,2-d]pyrimidin-2-yl)sulfanyl-propanamide Openeye Name: (2S)-2-(3-allyl-4-oxo-6-phenyl-thieno[3,2-d]pyrimidin-2-yl)sulfanyl-N-(ethylcarbamoyl)propanamide CAS Name: (2S)-N-(ethylcarbamoyl)-2-[(4-oxo-6-phenyl-3-prop-2-enyl-2-thieno[3,2-d]pyrimidinyl)thio]propanamide IUPAC Name: (2S)-N-(ethylcarbamoyl)-2-(4-oxo-6-phenyl-3-prop-2-enylthieno[3,2-d]pyrimidin-2-yl)sulfanylpropanamide Traditional Name: (2S)-2-[(3-allyl-4-keto-6-phenyl-thieno[3,2-d]pyrimidin-2-yl)thio]-N-(ethylcarbamoyl)propionamide Formula: C21H22N4O3S2 MolecularWeight: 442.55438

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C)SC1=NC2=C(C(=O)N1CC=C)SC(=C2)C3=CC=CC=C3

Isomeric SMILES

CCNC(=O)NC(=O)[C@H](C)SC1=NC2=C(C(=O)N1CC=C)SC(=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H22N4O3S2/c1-4-11-25-19(27)17-15(12-16(30-17)14-9-7-6-8-10-14)23-21(25)29-13(3)18(26)24-20(28)22-5-2/h4,6-10,12-13H,1,5,11H2,2-3H3,(H2,22,24,26,28)/t13-/m0/s1