2-(3-ethyl-4-oxidanylidene-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(phenylmethyl)propanamide

Systemtic Name: 2-(3-ethyl-4-oxidanylidene-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(phenylmethyl)propanamide Openeye Name: N-benzyl-2-[3-ethyl-4-oxo-5-(2-thienyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-propanamide CAS Name: 2-[(3-ethyl-4-oxo-5-thiophen-2-yl-2-thieno[2,3-d]pyrimidinyl)thio]-N-(phenylmethyl)propanamide IUPAC Name: N-benzyl-2-(3-ethyl-4-oxo-5-thiophen-2-ylthieno[2,3-d]pyrimidin-2-yl)sulfanylpropanamide Traditional Name: N-benzyl-2-[[3-ethyl-4-keto-5-(2-thienyl)thieno[2,3-d]pyrimidin-2-yl]thio]propionamide Formula: C22H21N3O2S3 MolecularWeight: 455.61604

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C1SC(C)C(=O)NCC3=CC=CC=C3)SC=C2C4=CC=CS4

Isomeric SMILES

CCN1C(=O)C2=C(N=C1SC(C)C(=O)NCC3=CC=CC=C3)SC=C2C4=CC=CS4

InChI

InChI=1S/C22H21N3O2S3/c1-3-25-21(27)18-16(17-10-7-11-28-17)13-29-20(18)24-22(25)30-14(2)19(26)23-12-15-8-5-4-6-9-15/h4-11,13-14H,3,12H2,1-2H3,(H,23,26)