3-methyl-2-[(1S)-1-phenylethyl]sulfanyl-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 3-methyl-2-[(1S)-1-phenylethyl]sulfanyl-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 3-methyl-2-[(1S)-1-phenylethyl]sulfanyl-5H-pyrimido[5,4-b]indol-4-one CAS Name: 3-methyl-2-[[(1S)-1-phenylethyl]thio]-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 3-methyl-2-[(1S)-1-phenylethyl]sulfanyl-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 3-methyl-2-[[(1S)-1-phenylethyl]thio]-5H-pyrimid[5,4-b]indol-4-one Formula: C19H17N3OS MolecularWeight: 335.42278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)SC2=NC3=C(C(=O)N2C)NC4=CC=CC=C43

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)SC2=NC3=C(C(=O)N2C)NC4=CC=CC=C43

InChI

InChI=1S/C19H17N3OS/c1-12(13-8-4-3-5-9-13)24-19-21-16-14-10-6-7-11-15(14)20-17(16)18(23)22(19)2/h3-12,20H,1-2H3/t12-/m0/s1