N-ethyl-2-(4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(phenylmethyl)propanamide

Systemtic Name: N-ethyl-2-(4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(phenylmethyl)propanamide Openeye Name: 2-(3-allyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-benzyl-N-ethyl-propanamide CAS Name: N-ethyl-2-[(4-oxo-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl)thio]-N-(phenylmethyl)propanamide IUPAC Name: N-benzyl-N-ethyl-2-(4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl)sulfanylpropanamide Traditional Name: 2-[(3-allyl-4-keto-thieno[2,3-d]pyrimidin-2-yl)thio]-N-benzyl-N-ethyl-propionamide Formula: C21H23N3O2S2 MolecularWeight: 413.55622

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C(=O)C(C)SC2=NC3=C(C=CS3)C(=O)N2CC=C

Isomeric SMILES

CCN(CC1=CC=CC=C1)C(=O)C(C)SC2=NC3=C(C=CS3)C(=O)N2CC=C

InChI

InChI=1S/C21H23N3O2S2/c1-4-12-24-20(26)17-11-13-27-18(17)22-21(24)28-15(3)19(25)23(5-2)14-16-9-7-6-8-10-16/h4,6-11,13,15H,1,5,12,14H2,2-3H3