1-butyl-3-(1-pyridin-4-ylethyl)thiourea

Systemtic Name: 1-butyl-3-(1-pyridin-4-ylethyl)thiourea Openeye Name: 1-butyl-3-[1-(4-pyridyl)ethyl]thiourea CAS Name: 1-butyl-3-(1-pyridin-4-ylethyl)thiourea IUPAC Name: 1-butyl-3-(1-pyridin-4-ylethyl)thiourea Traditional Name: 1-butyl-3-[1-(4-pyridyl)ethyl]thiourea Formula: C12H19N3S MolecularWeight: 237.36436

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NC(C)C1=CC=NC=C1

Isomeric SMILES

CCCCNC(=S)NC(C)C1=CC=NC=C1

InChI

InChI=1S/C12H19N3S/c1-3-4-7-14-12(16)15-10(2)11-5-8-13-9-6-11/h5-6,8-10H,3-4,7H2,1-2H3,(H2,14,15,16)