(3S,4S)-4-propyl-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-ol

Systemtic Name: (3S,4S)-4-propyl-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-ol Openeye Name: (3S,4S)-4-propyl-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-ol CAS Name: (3S,4S)-4-propyl-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-ol IUPAC Name: (3S,4S)-4-propyl-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-ol Traditional Name: (3S,4S)-4-propyl-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-ol Formula: C12H17NOS MolecularWeight: 223.33448

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(CSC2=CC=CC=C2N1)O

Isomeric SMILES

CCC[C@H]1[C@@H](CSC2=CC=CC=C2N1)O

InChI

InChI=1S/C12H17NOS/c1-2-5-9-11(14)8-15-12-7-4-3-6-10(12)13-9/h3-4,6-7,9,11,13-14H,2,5,8H2,1H3/t9-,11+/m0/s1