2-azanyl-N-[2-(3-methanoyl-1,2,3,4-tetrahydroisoquinolin-1-yl)-2-oxidanylidene-ethyl]-3-sulfanyl-propanamide

Systemtic Name: 2-azanyl-N-[2-(3-methanoyl-1,2,3,4-tetrahydroisoquinolin-1-yl)-2-oxidanylidene-ethyl]-3-sulfanyl-propanamide Openeye Name: 2-amino-N-[2-(3-formyl-1,2,3,4-tetrahydroisoquinolin-1-yl)-2-oxo-ethyl]-3-sulfanyl-propanamide CAS Name: 2-amino-N-[2-(3-formyl-1,2,3,4-tetrahydroisoquinolin-1-yl)-2-oxoethyl]-3-mercaptopropanamide IUPAC Name: 2-amino-N-[2-(3-formyl-1,2,3,4-tetrahydroisoquinolin-1-yl)-2-oxoethyl]-3-sulfanylpropanamide Traditional Name: 2-amino-N-[2-(3-formyl-1,2,3,4-tetrahydroisoquinolin-1-yl)-2-keto-ethyl]-3-mercapto-propionamide Formula: C15H19N3O3S MolecularWeight: 321.39466

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC(C2=CC=CC=C21)C(=O)CNC(=O)C(CS)N)C=O

Isomeric SMILES

C1C(NC(C2=CC=CC=C21)C(=O)CNC(=O)C(CS)N)C=O

InChI

InChI=1S/C15H19N3O3S/c16-12(8-22)15(21)17-6-13(20)14-11-4-2-1-3-9(11)5-10(7-19)18-14/h1-4,7,10,12,14,18,22H,5-6,8,16H2,(H,17,21)