1-[2-(3-bromanyl-4-methoxy-phenyl)ethyl]-3-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 1-[2-(3-bromanyl-4-methoxy-phenyl)ethyl]-3-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-[2-(3-bromo-4-methoxy-phenyl)ethyl]-3-(3-pyridylmethyl)thiourea CAS Name: 1-[2-(3-bromo-4-methoxyphenyl)ethyl]-3-(3-pyridinylmethyl)thiourea IUPAC Name: 1-[2-(3-bromo-4-methoxyphenyl)ethyl]-3-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-[2-(3-bromo-4-methoxy-phenyl)ethyl]-3-(3-pyridylmethyl)thiourea Formula: C16H18BrN3OS MolecularWeight: 380.30262

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=S)NCC2=CN=CC=C2)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=S)NCC2=CN=CC=C2)Br

InChI

InChI=1S/C16H18BrN3OS/c1-21-15-5-4-12(9-14(15)17)6-8-19-16(22)20-11-13-3-2-7-18-10-13/h2-5,7,9-10H,6,8,11H2,1H3,(H2,19,20,22)