1-butyl-3-[3-[(E)-2-pyridin-2-ylethenyl]phenyl]thiourea

Systemtic Name: 1-butyl-3-[3-[(E)-2-pyridin-2-ylethenyl]phenyl]thiourea Openeye Name: 1-butyl-3-[3-[(E)-2-(2-pyridyl)vinyl]phenyl]thiourea CAS Name: 1-butyl-3-[3-[(E)-2-(2-pyridinyl)ethenyl]phenyl]thiourea IUPAC Name: 1-butyl-3-[3-[(E)-2-pyridin-2-ylethenyl]phenyl]thiourea Traditional Name: 1-butyl-3-[3-[(E)-2-(2-pyridyl)vinyl]phenyl]thiourea Formula: C18H21N3S MolecularWeight: 311.44444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NC1=CC=CC(=C1)C=CC2=CC=CC=N2

Isomeric SMILES

CCCCNC(=S)NC1=CC=CC(=C1)/C=C/C2=CC=CC=N2

InChI

InChI=1S/C18H21N3S/c1-2-3-12-20-18(22)21-17-9-6-7-15(14-17)10-11-16-8-4-5-13-19-16/h4-11,13-14H,2-3,12H2,1H3,(H2,20,21,22)/b11-10+