N-(3-methylbutylamino)-2-oxidanyl-N-sulfanyl-propanamide; (2-methylcyclopropyl)methylbenzene

Systemtic Name: N-(3-methylbutylamino)-2-oxidanyl-N-sulfanyl-propanamide; (2-methylcyclopropyl)methylbenzene Openeye Name: 2-hydroxy-N-(isopentylamino)-N-sulfanyl-propanamide; (2-methylcyclopropyl)methylbenzene CAS Name: 2-hydroxy-N-mercapto-N-(3-methylbutylamino)propanamide; (2-methylcyclopropyl)methylbenzene IUPAC Name: 2-hydroxy-N-(3-methylbutylamino)-N-sulfanylpropanamide; (2-methylcyclopropyl)methylbenzene Traditional Name: 2-hydroxy-N-(isoamylamino)-N-mercapto-propionamide; (2-methylcyclopropyl)methylbenzene Formula: C19H32N2O2S MolecularWeight: 352.53458

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC1CC2=CC=CC=C2.CC(C)CCNN(C(=O)C(C)O)S

Isomeric SMILES

CC1CC1CC2=CC=CC=C2.CC(C)CCNN(C(=O)C(C)O)S

InChI

InChI=1S/C11H14.C8H18N2O2S/c1-9-7-11(9)8-10-5-3-2-4-6-10;1-6(2)4-5-9-10(13)8(12)7(3)11/h2-6,9,11H,7-8H2,1H3;6-7,9,11,13H,4-5H2,1-3H3