6-oxidanyl-1-prop-2-enyl-2-sulfanylidene-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidin-4-one

Systemtic Name: 6-oxidanyl-1-prop-2-enyl-2-sulfanylidene-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidin-4-one Openeye Name: 1-allyl-6-hydroxy-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-2-thioxo-pyrimidin-4-one CAS Name: 6-hydroxy-1-prop-2-enyl-2-sulfanylidene-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)-4-pyrimidinone IUPAC Name: 6-hydroxy-1-prop-2-enyl-2-sulfanylidene-5-(2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl)pyrimidin-4-one Traditional Name: 1-allyl-6-hydroxy-5-(2,3,4,9-tetrahydro-1H-$b-carbolin-1-yl)-2-thioxo-pyrimidin-4-one Formula: C18H18N4O2S MolecularWeight: 354.42612

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=C(C(=O)NC1=S)C2C3=C(CCN2)C4=CC=CC=C4N3)O

Isomeric SMILES

C=CCN1C(=C(C(=O)NC1=S)C2C3=C(CCN2)C4=CC=CC=C4N3)O

InChI

InChI=1S/C18H18N4O2S/c1-2-9-22-17(24)13(16(23)21-18(22)25)15-14-11(7-8-19-15)10-5-3-4-6-12(10)20-14/h2-6,15,19-20,24H,1,7-9H2,(H,21,23,25)