2-[[2-azanyl-3-(1-benzothiophen-3-yl)propyl]amino]-3,5-dimethyl-6-pyridin-4-yl-pyrimidin-4-one

Systemtic Name: 2-[[2-azanyl-3-(1-benzothiophen-3-yl)propyl]amino]-3,5-dimethyl-6-pyridin-4-yl-pyrimidin-4-one Openeye Name: 2-[[2-amino-3-(benzothiophen-3-yl)propyl]amino]-3,5-dimethyl-6-(4-pyridyl)pyrimidin-4-one CAS Name: 2-[[2-amino-3-(1-benzothiophen-3-yl)propyl]amino]-3,5-dimethyl-6-pyridin-4-yl-4-pyrimidinone IUPAC Name: 2-[[2-amino-3-(1-benzothiophen-3-yl)propyl]amino]-3,5-dimethyl-6-pyridin-4-ylpyrimidin-4-one Traditional Name: 2-[[2-amino-3-(benzothiophen-3-yl)propyl]amino]-3,5-dimethyl-6-(4-pyridyl)pyrimidin-4-one Formula: C22H23N5OS MolecularWeight: 405.51592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N(C1=O)C)NCC(CC2=CSC3=CC=CC=C32)N)C4=CC=NC=C4

Isomeric SMILES

CC1=C(N=C(N(C1=O)C)NCC(CC2=CSC3=CC=CC=C32)N)C4=CC=NC=C4

InChI

InChI=1S/C22H23N5OS/c1-14-20(15-7-9-24-10-8-15)26-22(27(2)21(14)28)25-12-17(23)11-16-13-29-19-6-4-3-5-18(16)19/h3-10,13,17H,11-12,23H2,1-2H3,(H,25,26)