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3-[1-(phenylmethyl)piperidin-4-yl]-2-sulfanylidene-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one

3-[1-(phenylmethyl)piperidin-4-yl]-2-sulfanylidene-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one

Systemtic Name:3-[1-(phenylmethyl)piperidin-4-yl]-2-sulfanylidene-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one
Openeye Name:3-(1-benzyl-4-piperidyl)-2-thioxo-1H-benzothiopheno[3,2-d]pyrimidin-4-one
CAS Name:3-[1-(phenylmethyl)-4-piperidinyl]-2-sulfanylidene-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one
IUPAC Name:3-(1-benzylpiperidin-4-yl)-2-sulfanylidene-1H-[1]benzothiolo[3,2-d]pyrimidin-4-one
Traditional Name:3-(1-benzyl-4-piperidyl)-2-thioxo-1H-benzothiopheno[3,2-d]pyrimidin-4-one
Formula: C22H21N3OS2
MolecularWeight: 407.55164
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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C(=O)C3=C(C4=CC=CC=C4S3)NC2=S)CC5=CC=CC=C5


Isomeric SMILES

C1CN(CCC1N2C(=O)C3=C(C4=CC=CC=C4S3)NC2=S)CC5=CC=CC=C5


InChI

InChI=1S/C22H21N3OS2/c26-21-20-19(17-8-4-5-9-18(17)28-20)23-22(27)25(21)16-10-12-24(13-11-16)14-15-6-2-1-3-7-15/h1-9,16H,10-14H2,(H,23,27)


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