2-methylsulfanyl-N-(1-pyridin-4-ylethyl)-1,3-benzothiazol-6-amine

Systemtic Name: 2-methylsulfanyl-N-(1-pyridin-4-ylethyl)-1,3-benzothiazol-6-amine Openeye Name: 2-methylsulfanyl-N-[1-(4-pyridyl)ethyl]-1,3-benzothiazol-6-amine CAS Name: 2-(methylthio)-N-(1-pyridin-4-ylethyl)-1,3-benzothiazol-6-amine IUPAC Name: 2-methylsulfanyl-N-(1-pyridin-4-ylethyl)-1,3-benzothiazol-6-amine Traditional Name: [2-(methylthio)-1,3-benzothiazol-6-yl]-[1-(4-pyridyl)ethyl]amine Formula: C15H15N3S2 MolecularWeight: 301.4297

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=NC=C1)NC2=CC3=C(C=C2)N=C(S3)SC

Isomeric SMILES

CC(C1=CC=NC=C1)NC2=CC3=C(C=C2)N=C(S3)SC

InChI

InChI=1S/C15H15N3S2/c1-10(11-5-7-16-8-6-11)17-12-3-4-13-14(9-12)20-15(18-13)19-2/h3-10,17H,1-2H3