2-[1-(3-azanylpiperidin-1-yl)propyl]-3-(phenylmethyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[1-(3-azanylpiperidin-1-yl)propyl]-3-(phenylmethyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[1-(3-amino-1-piperidyl)propyl]-3-benzyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[1-(3-amino-1-piperidinyl)propyl]-3-(phenylmethyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[1-(3-aminopiperidin-1-yl)propyl]-3-benzylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[1-(3-aminopiperidino)propyl]-3-benzyl-thieno[2,3-d]pyrimidin-4-one Formula: C21H26N4OS MolecularWeight: 382.52234

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=C(C=CS2)C(=O)N1CC3=CC=CC=C3)N4CCCC(C4)N

Isomeric SMILES

CCC(C1=NC2=C(C=CS2)C(=O)N1CC3=CC=CC=C3)N4CCCC(C4)N

InChI

InChI=1S/C21H26N4OS/c1-2-18(24-11-6-9-16(22)14-24)19-23-20-17(10-12-27-20)21(26)25(19)13-15-7-4-3-5-8-15/h3-5,7-8,10,12,16,18H,2,6,9,11,13-14,22H2,1H3