3-(2-hydroxyethyl)-8-methoxy-5-methyl-2-(2-methylpropylsulfanyl)pyrimido[5,4-b]indol-4-one

Systemtic Name: 3-(2-hydroxyethyl)-8-methoxy-5-methyl-2-(2-methylpropylsulfanyl)pyrimido[5,4-b]indol-4-one Openeye Name: 3-(2-hydroxyethyl)-2-isobutylsulfanyl-8-methoxy-5-methyl-pyrimido[5,4-b]indol-4-one CAS Name: 3-(2-hydroxyethyl)-8-methoxy-5-methyl-2-(2-methylpropylthio)-4-pyrimido[5,4-b]indolone IUPAC Name: 3-(2-hydroxyethyl)-8-methoxy-5-methyl-2-(2-methylpropylsulfanyl)pyrimido[5,4-b]indol-4-one Traditional Name: 3-(2-hydroxyethyl)-2-(isobutylthio)-8-methoxy-5-methyl-pyrimid[5,4-b]indol-4-one Formula: C18H23N3O3S MolecularWeight: 361.45852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=NC2=C(C(=O)N1CCO)N(C3=C2C=C(C=C3)OC)C

Isomeric SMILES

CC(C)CSC1=NC2=C(C(=O)N1CCO)N(C3=C2C=C(C=C3)OC)C

InChI

InChI=1S/C18H23N3O3S/c1-11(2)10-25-18-19-15-13-9-12(24-4)5-6-14(13)20(3)16(15)17(23)21(18)7-8-22/h5-6,9,11,22H,7-8,10H2,1-4H3