N,N-diethyl-4,4-dithiophen-2-yl-but-3-en-2-amine hydrochloride

Systemtic Name: N,N-diethyl-4,4-dithiophen-2-yl-but-3-en-2-amine hydrochloride Openeye Name: N,N-diethyl-4,4-bis(2-thienyl)but-3-en-2-amine hydrochloride CAS Name: N,N-diethyl-4,4-dithiophen-2-yl-3-buten-2-amine hydrochloride IUPAC Name: N,N-diethyl-4,4-dithiophen-2-ylbut-3-en-2-amine hydrochloride Traditional Name: diethyl-[1-methyl-3,3-bis(2-thienyl)allyl]amine hydrochloride Formula: C16H22ClNS2 MolecularWeight: 327.93558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(C)C=C(C1=CC=CS1)C2=CC=CS2.Cl

Isomeric SMILES

CCN(CC)C(C)C=C(C1=CC=CS1)C2=CC=CS2.Cl

InChI

InChI=1S/C16H21NS2.ClH/c1-4-17(5-2)13(3)12-14(15-8-6-10-18-15)16-9-7-11-19-16;/h6-13H,4-5H2,1-3H3;1H