(3aS,7aR)-2-pyrrol-1-yl-3a,4,5,6,7,7a-hexahydro-1,3-benzothiazole

Systemtic Name: (3aS,7aR)-2-pyrrol-1-yl-3a,4,5,6,7,7a-hexahydro-1,3-benzothiazole Openeye Name: (3aS,7aR)-2-pyrrol-1-yl-3a,4,5,6,7,7a-hexahydro-1,3-benzothiazole CAS Name: (3aS,7aR)-2-(1-pyrrolyl)-3a,4,5,6,7,7a-hexahydro-1,3-benzothiazole IUPAC Name: (3aS,7aR)-2-pyrrol-1-yl-3a,4,5,6,7,7a-hexahydro-1,3-benzothiazole Traditional Name: (3aS,7aR)-2-pyrrol-1-yl-3a,4,5,6,7,7a-hexahydro-1,3-benzothiazole Formula: C11H14N2S MolecularWeight: 206.30726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2C(C1)N=C(S2)N3C=CC=C3

Isomeric SMILES

C1CC[C@@H]2[C@H](C1)N=C(S2)N3C=CC=C3

InChI

InChI=1S/C11H14N2S/c1-2-6-10-9(5-1)12-11(14-10)13-7-3-4-8-13/h3-4,7-10H,1-2,5-6H2/t9-,10+/m0/s1