3-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]-2-(pyrrolidin-1-ylmethyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[2-(2,3-dihydroindol-1-yl)-2-oxidanylidene-ethyl]-2-(pyrrolidin-1-ylmethyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: 3-(2-indolin-1-yl-2-oxo-ethyl)-2-(pyrrolidin-1-ylmethyl)-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one CAS Name: 3-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-2-(1-pyrrolidinylmethyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: 3-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-2-(pyrrolidin-1-ylmethyl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: 3-(2-indolin-1-yl-2-keto-ethyl)-2-(pyrrolidinomethyl)-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one Formula: C25H28N4O2S MolecularWeight: 448.58042

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=C(S2)N=C(N(C3=O)CC(=O)N4CCC5=CC=CC=C54)CN6CCCC6

Isomeric SMILES

C1CCC2=C(C1)C3=C(S2)N=C(N(C3=O)CC(=O)N4CCC5=CC=CC=C54)CN6CCCC6

InChI

InChI=1S/C25H28N4O2S/c30-22(28-14-11-17-7-1-3-9-19(17)28)16-29-21(15-27-12-5-6-13-27)26-24-23(25(29)31)18-8-2-4-10-20(18)32-24/h1,3,7,9H,2,4-6,8,10-16H2