7-tert-butyl-N-cyclopropyl-2,3,4,5-tetrahydro-1-benzothiepin-5-amine

Systemtic Name: 7-tert-butyl-N-cyclopropyl-2,3,4,5-tetrahydro-1-benzothiepin-5-amine Openeye Name: 7-tert-butyl-N-cyclopropyl-2,3,4,5-tetrahydro-1-benzothiepin-5-amine CAS Name: 7-tert-butyl-N-cyclopropyl-2,3,4,5-tetrahydro-1-benzothiepin-5-amine IUPAC Name: 7-tert-butyl-N-cyclopropyl-2,3,4,5-tetrahydro-1-benzothiepin-5-amine Traditional Name: (7-tert-butyl-2,3,4,5-tetrahydro-1-benzothiepin-5-yl)-cyclopropyl-amine Formula: C17H25NS MolecularWeight: 275.4521

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)SCCCC2NC3CC3

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)SCCCC2NC3CC3

InChI

InChI=1S/C17H25NS/c1-17(2,3)12-6-9-16-14(11-12)15(5-4-10-19-16)18-13-7-8-13/h6,9,11,13,15,18H,4-5,7-8,10H2,1-3H3