2-[2-(2,6-dimethylmorpholin-4-yl)-2-oxidanylidene-ethyl]sulfanyl-3-prop-2-enyl-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 2-[2-(2,6-dimethylmorpholin-4-yl)-2-oxidanylidene-ethyl]sulfanyl-3-prop-2-enyl-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 3-allyl-2-[2-(2,6-dimethylmorpholin-4-yl)-2-oxo-ethyl]sulfanyl-5H-pyrimido[5,4-b]indol-4-one CAS Name: 2-[[2-(2,6-dimethyl-4-morpholinyl)-2-oxoethyl]thio]-3-prop-2-enyl-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 2-[2-(2,6-dimethylmorpholin-4-yl)-2-oxoethyl]sulfanyl-3-prop-2-enyl-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 3-allyl-2-[[2-(2,6-dimethylmorpholino)-2-keto-ethyl]thio]-5H-pyrimid[5,4-b]indol-4-one Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C(=O)CSC2=NC3=C(C(=O)N2CC=C)NC4=CC=CC=C43

Isomeric SMILES

CC1CN(CC(O1)C)C(=O)CSC2=NC3=C(C(=O)N2CC=C)NC4=CC=CC=C43

InChI

InChI=1S/C21H24N4O3S/c1-4-9-25-20(27)19-18(15-7-5-6-8-16(15)22-19)23-21(25)29-12-17(26)24-10-13(2)28-14(3)11-24/h4-8,13-14,22H,1,9-12H2,2-3H3