1-[4-[(2-azanyl-3-sulfanyl-propyl)-methyl-amino]-3-methyl-butyl]-1,2,3,4-tetrahydroisoquinoline-3-carbaldehyde

Systemtic Name: 1-[4-[(2-azanyl-3-sulfanyl-propyl)-methyl-amino]-3-methyl-butyl]-1,2,3,4-tetrahydroisoquinoline-3-carbaldehyde Openeye Name: 1-[4-[(2-amino-3-sulfanyl-propyl)-methyl-amino]-3-methyl-butyl]-1,2,3,4-tetrahydroisoquinoline-3-carbaldehyde CAS Name: 1-[4-[(2-amino-3-mercaptopropyl)-methylamino]-3-methylbutyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxaldehyde IUPAC Name: 1-[4-[(2-amino-3-sulfanylpropyl)-methylamino]-3-methylbutyl]-1,2,3,4-tetrahydroisoquinoline-3-carbaldehyde Traditional Name: 1-[4-[(2-amino-3-mercapto-propyl)-methyl-amino]-3-methyl-butyl]-1,2,3,4-tetrahydroisoquinoline-3-carbaldehyde Formula: C19H31N3OS MolecularWeight: 349.53394

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1C2=CC=CC=C2CC(N1)C=O)CN(C)CC(CS)N

Isomeric SMILES

CC(CCC1C2=CC=CC=C2CC(N1)C=O)CN(C)CC(CS)N

InChI

InChI=1S/C19H31N3OS/c1-14(10-22(2)11-16(20)13-24)7-8-19-18-6-4-3-5-15(18)9-17(12-23)21-19/h3-6,12,14,16-17,19,21,24H,7-11,13,20H2,1-2H3