1-[2-(4-chlorophenyl)sulfanylethyl]-3-(1-pyridin-4-ylethyl)thiourea

Systemtic Name: 1-[2-(4-chlorophenyl)sulfanylethyl]-3-(1-pyridin-4-ylethyl)thiourea Openeye Name: 1-[2-(4-chlorophenyl)sulfanylethyl]-3-[1-(4-pyridyl)ethyl]thiourea CAS Name: 1-[2-[(4-chlorophenyl)thio]ethyl]-3-(1-pyridin-4-ylethyl)thiourea IUPAC Name: 1-[2-(4-chlorophenyl)sulfanylethyl]-3-(1-pyridin-4-ylethyl)thiourea Traditional Name: 1-[2-[(4-chlorophenyl)thio]ethyl]-3-[1-(4-pyridyl)ethyl]thiourea Formula: C16H18ClN3S2 MolecularWeight: 351.91722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=NC=C1)NC(=S)NCCSC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C1=CC=NC=C1)NC(=S)NCCSC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H18ClN3S2/c1-12(13-6-8-18-9-7-13)20-16(21)19-10-11-22-15-4-2-14(17)3-5-15/h2-9,12H,10-11H2,1H3,(H2,19,20,21)