2-[(3-oxidanylidenebenzo[f]chromen-1-yl)methylsulfanyl]-3-prop-2-enyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(3-oxidanylidenebenzo[f]chromen-1-yl)methylsulfanyl]-3-prop-2-enyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-2-[(3-oxobenzo[f]chromen-1-yl)methylsulfanyl]-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(3-oxo-1-benzo[f][1]benzopyranyl)methylthio]-3-prop-2-enyl-5-thiophen-2-yl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(3-oxobenzo[f]chromen-1-yl)methylsulfanyl]-3-prop-2-enyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-2-[(3-ketobenzo[f]chromen-1-yl)methylthio]-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-one Formula: C27H18N2O3S3 MolecularWeight: 514.63842

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(N=C1SCC3=CC(=O)OC4=C3C5=CC=CC=C5C=C4)SC=C2C6=CC=CS6

Isomeric SMILES

C=CCN1C(=O)C2=C(N=C1SCC3=CC(=O)OC4=C3C5=CC=CC=C5C=C4)SC=C2C6=CC=CS6

InChI

InChI=1S/C27H18N2O3S3/c1-2-11-29-26(31)24-19(21-8-5-12-33-21)15-34-25(24)28-27(29)35-14-17-13-22(30)32-20-10-9-16-6-3-4-7-18(16)23(17)20/h2-10,12-13,15H,1,11,14H2