N-(4-tert-butylphenyl)-3-[5-(furan-2-yl)-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(4-tert-butylphenyl)-3-[5-(furan-2-yl)-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-propanamide Openeye Name: 3-[3-allyl-5-(2-furyl)-4-oxo-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-(4-tert-butylphenyl)propanamide CAS Name: N-(4-tert-butylphenyl)-3-[[5-(2-furanyl)-4-oxo-3-prop-2-enyl-2-thieno[2,3-d]pyrimidinyl]thio]propanamide IUPAC Name: N-(4-tert-butylphenyl)-3-[5-(furan-2-yl)-4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl]sulfanylpropanamide Traditional Name: 3-[[3-allyl-5-(2-furyl)-4-keto-thieno[2,3-d]pyrimidin-2-yl]thio]-N-(4-tert-butylphenyl)propionamide Formula: C26H27N3O3S2 MolecularWeight: 493.64088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=O)CCSC2=NC3=C(C(=CS3)C4=CC=CO4)C(=O)N2CC=C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=O)CCSC2=NC3=C(C(=CS3)C4=CC=CO4)C(=O)N2CC=C

InChI

InChI=1S/C26H27N3O3S2/c1-5-13-29-24(31)22-19(20-7-6-14-32-20)16-34-23(22)28-25(29)33-15-12-21(30)27-18-10-8-17(9-11-18)26(2,3)4/h5-11,14,16H,1,12-13,15H2,2-4H3,(H,27,30)