1-[(5-bromanylpyridin-3-yl)carbonylamino]-3-(4-butylphenyl)thiourea

Systemtic Name: 1-[(5-bromanylpyridin-3-yl)carbonylamino]-3-(4-butylphenyl)thiourea Openeye Name: 1-[(5-bromopyridine-3-carbonyl)amino]-3-(4-butylphenyl)thiourea CAS Name: 1-[[(5-bromo-3-pyridinyl)-oxomethyl]amino]-3-(4-butylphenyl)thiourea IUPAC Name: 1-[(5-bromopyridine-3-carbonyl)amino]-3-(4-butylphenyl)thiourea Traditional Name: 1-[(5-bromonicotinoyl)amino]-3-(4-butylphenyl)thiourea Formula: C17H19BrN4OS MolecularWeight: 407.32796

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NNC(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C17H19BrN4OS/c1-2-3-4-12-5-7-15(8-6-12)20-17(24)22-21-16(23)13-9-14(18)11-19-10-13/h5-11H,2-4H2,1H3,(H,21,23)(H2,20,22,24)