2-azanyl-3-methyl-N-[(4-sulfanylpyrrolidin-2-yl)methyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pentanamide

Systemtic Name: 2-azanyl-3-methyl-N-[(4-sulfanylpyrrolidin-2-yl)methyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pentanamide Openeye Name: 2-amino-3-methyl-N-[(4-sulfanylpyrrolidin-2-yl)methyl]-N-tetralin-1-yl-pentanamide CAS Name: 2-amino-N-[(4-mercapto-2-pyrrolidinyl)methyl]-3-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pentanamide IUPAC Name: 2-amino-3-methyl-N-[(4-sulfanylpyrrolidin-2-yl)methyl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pentanamide Traditional Name: 2-amino-N-[(4-mercaptopyrrolidin-2-yl)methyl]-3-methyl-N-tetralin-1-yl-valeramide Formula: C21H33N3OS MolecularWeight: 375.57122

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N(CC1CC(CN1)S)C2CCCC3=CC=CC=C23)N

Isomeric SMILES

CCC(C)C(C(=O)N(CC1CC(CN1)S)C2CCCC3=CC=CC=C23)N

InChI

InChI=1S/C21H33N3OS/c1-3-14(2)20(22)21(25)24(13-16-11-17(26)12-23-16)19-10-6-8-15-7-4-5-9-18(15)19/h4-5,7,9,14,16-17,19-20,23,26H,3,6,8,10-13,22H2,1-2H3