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

Systemtic Name: 2-azanyl-N-[1-(3-methanoyl-1,2,3,4-tetrahydroisoquinolin-1-yl)-3-methyl-1-oxidanylidene-butan-2-yl]-3-sulfanyl-propanamide Openeye Name: 2-amino-N-[1-(3-formyl-1,2,3,4-tetrahydroisoquinoline-1-carbonyl)-2-methyl-propyl]-3-sulfanyl-propanamide CAS Name: 2-amino-N-[1-(3-formyl-1,2,3,4-tetrahydroisoquinolin-1-yl)-3-methyl-1-oxobutan-2-yl]-3-mercaptopropanamide IUPAC Name: 2-amino-N-[1-(3-formyl-1,2,3,4-tetrahydroisoquinolin-1-yl)-3-methyl-1-oxobutan-2-yl]-3-sulfanylpropanamide Traditional Name: 2-amino-N-[1-(3-formyl-1,2,3,4-tetrahydroisoquinoline-1-carbonyl)-2-methyl-propyl]-3-mercapto-propionamide Formula: C18H25N3O3S MolecularWeight: 363.4744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)C1C2=CC=CC=C2CC(N1)C=O)NC(=O)C(CS)N

Isomeric SMILES

CC(C)C(C(=O)C1C2=CC=CC=C2CC(N1)C=O)NC(=O)C(CS)N

InChI

InChI=1S/C18H25N3O3S/c1-10(2)15(21-18(24)14(19)9-25)17(23)16-13-6-4-3-5-11(13)7-12(8-22)20-16/h3-6,8,10,12,14-16,20,25H,7,9,19H2,1-2H3,(H,21,24)