1,4a-dimethyl-6-sulfanyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxamide

Systemtic Name: 1,4a-dimethyl-6-sulfanyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxamide Openeye Name: 1,4a-dimethyl-6-sulfanyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxamide CAS Name: 6-mercapto-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxamide IUPAC Name: 1,4a-dimethyl-6-sulfanyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxamide Traditional Name: 6-mercapto-1,4a-dimethyl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxamide Formula: C17H23NOS MolecularWeight: 289.43562

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCCC(C1CCC3=C2C=C(C=C3)S)(C)C(=O)N

Isomeric SMILES

CC12CCCC(C1CCC3=C2C=C(C=C3)S)(C)C(=O)N

InChI

InChI=1S/C17H23NOS/c1-16-8-3-9-17(2,15(18)19)14(16)7-5-11-4-6-12(20)10-13(11)16/h4,6,10,14,20H,3,5,7-9H2,1-2H3,(H2,18,19)