5-(3-methoxyphenyl)-2-[(prop-2-enylamino)methyl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(3-methoxyphenyl)-2-[(prop-2-enylamino)methyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(allylamino)methyl]-5-(3-methoxyphenyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(3-methoxyphenyl)-2-[(prop-2-enylamino)methyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-(3-methoxyphenyl)-2-[(prop-2-enylamino)methyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(allylamino)methyl]-5-(3-methoxyphenyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=CSC3=C2C(=O)NC(=N3)CNCC=C

Isomeric SMILES

COC1=CC=CC(=C1)C2=CSC3=C2C(=O)NC(=N3)CNCC=C

InChI

InChI=1S/C17H17N3O2S/c1-3-7-18-9-14-19-16(21)15-13(10-23-17(15)20-14)11-5-4-6-12(8-11)22-2/h3-6,8,10,18H,1,7,9H2,2H3,(H,19,20,21)