2-(2-piperidin-1-ylethylsulfanyl)-3-prop-2-enyl-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 2-(2-piperidin-1-ylethylsulfanyl)-3-prop-2-enyl-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 3-allyl-2-[2-(1-piperidyl)ethylsulfanyl]-5H-pyrimido[5,4-b]indol-4-one CAS Name: 2-[2-(1-piperidinyl)ethylthio]-3-prop-2-enyl-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 2-(2-piperidin-1-ylethylsulfanyl)-3-prop-2-enyl-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 3-allyl-2-(2-piperidinoethylthio)-5H-pyrimid[5,4-b]indol-4-one Formula: C20H24N4OS MolecularWeight: 368.49576

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C3=CC=CC=C3N2)N=C1SCCN4CCCCC4

Isomeric SMILES

C=CCN1C(=O)C2=C(C3=CC=CC=C3N2)N=C1SCCN4CCCCC4

InChI

InChI=1S/C20H24N4OS/c1-2-10-24-19(25)18-17(15-8-4-5-9-16(15)21-18)22-20(24)26-14-13-23-11-6-3-7-12-23/h2,4-5,8-9,21H,1,3,6-7,10-14H2