2-(1,4-diazepan-1-ylmethyl)-3-(2-ethoxyphenyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-(1,4-diazepan-1-ylmethyl)-3-(2-ethoxyphenyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-(1,4-diazepan-1-ylmethyl)-3-(2-ethoxyphenyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 2-(1,4-diazepan-1-ylmethyl)-3-(2-ethoxyphenyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-(1,4-diazepan-1-ylmethyl)-3-(2-ethoxyphenyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(1,4-diazepan-1-ylmethyl)-3-o-phenetyl-thieno[2,3-d]pyrimidin-4-one Formula: C20H24N4O2S MolecularWeight: 384.49516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2C(=NC3=C(C2=O)C=CS3)CN4CCCNCC4

Isomeric SMILES

CCOC1=CC=CC=C1N2C(=NC3=C(C2=O)C=CS3)CN4CCCNCC4

InChI

InChI=1S/C20H24N4O2S/c1-2-26-17-7-4-3-6-16(17)24-18(14-23-11-5-9-21-10-12-23)22-19-15(20(24)25)8-13-27-19/h3-4,6-8,13,21H,2,5,9-12,14H2,1H3