8-[(phenylmethyl)amino]-3,4,5,6-tetrahydro-1,3,7-thiadiazocine-2-thione

Systemtic Name: 8-[(phenylmethyl)amino]-3,4,5,6-tetrahydro-1,3,7-thiadiazocine-2-thione Openeye Name: 8-(benzylamino)-3,4,5,6-tetrahydro-1,3,7-thiadiazocine-2-thione CAS Name: 8-[(phenylmethyl)amino]-3,4,5,6-tetrahydro-1,3,7-thiadiazocine-2-thione IUPAC Name: 8-(benzylamino)-3,4,5,6-tetrahydro-1,3,7-thiadiazocine-2-thione Traditional Name: 8-(benzylamino)-3,4,5,6-tetrahydro-1,3,7-thiadiazocine-2-thione Formula: C12H15N3S2 MolecularWeight: 265.3976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=S)SC(=NC1)NCC2=CC=CC=C2

Isomeric SMILES

C1CNC(=S)SC(=NC1)NCC2=CC=CC=C2

InChI

InChI=1S/C12H15N3S2/c16-12-14-8-4-7-13-11(17-12)15-9-10-5-2-1-3-6-10/h1-3,5-6H,4,7-9H2,(H,13,15)(H,14,16)