1-[(6-chloranylpyridin-3-yl)methyl]-1-methyl-3-(phenylmethyl)thiourea

Systemtic Name: 1-[(6-chloranylpyridin-3-yl)methyl]-1-methyl-3-(phenylmethyl)thiourea Openeye Name: 3-benzyl-1-[(6-chloro-3-pyridyl)methyl]-1-methyl-thiourea CAS Name: 1-[(6-chloro-3-pyridinyl)methyl]-1-methyl-3-(phenylmethyl)thiourea IUPAC Name: 3-benzyl-1-[(6-chloropyridin-3-yl)methyl]-1-methylthiourea Traditional Name: 3-benzyl-1-[(6-chloro-3-pyridyl)methyl]-1-methyl-thiourea Formula: C15H16ClN3S MolecularWeight: 305.82564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN=C(C=C1)Cl)C(=S)NCC2=CC=CC=C2

Isomeric SMILES

CN(CC1=CN=C(C=C1)Cl)C(=S)NCC2=CC=CC=C2

InChI

InChI=1S/C15H16ClN3S/c1-19(11-13-7-8-14(16)17-10-13)15(20)18-9-12-5-3-2-4-6-12/h2-8,10H,9,11H2,1H3,(H,18,20)