1-[1-(3-sulfanylpropyl)pyrrolidin-2-yl]carbonyl-1,2,3,4-tetrahydroisoquinoline-3-carbaldehyde

Systemtic Name: 1-[1-(3-sulfanylpropyl)pyrrolidin-2-yl]carbonyl-1,2,3,4-tetrahydroisoquinoline-3-carbaldehyde Openeye Name: 1-[1-(3-sulfanylpropyl)pyrrolidine-2-carbonyl]-1,2,3,4-tetrahydroisoquinoline-3-carbaldehyde CAS Name: 1-[[1-(3-mercaptopropyl)-2-pyrrolidinyl]-oxomethyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxaldehyde IUPAC Name: 1-[1-(3-sulfanylpropyl)pyrrolidine-2-carbonyl]-1,2,3,4-tetrahydroisoquinoline-3-carbaldehyde Traditional Name: 1-[1-(3-mercaptopropyl)prolyl]-1,2,3,4-tetrahydroisoquinoline-3-carbaldehyde Formula: C18H24N2O2S MolecularWeight: 332.46036

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)CCCS)C(=O)C2C3=CC=CC=C3CC(N2)C=O

Isomeric SMILES

C1CC(N(C1)CCCS)C(=O)C2C3=CC=CC=C3CC(N2)C=O

InChI

InChI=1S/C18H24N2O2S/c21-12-14-11-13-5-1-2-6-15(13)17(19-14)18(22)16-7-3-8-20(16)9-4-10-23/h1-2,5-6,12,14,16-17,19,23H,3-4,7-11H2