1-(3-methylbutyl)-3-(quinolin-2-ylcarbonylamino)thiourea

Systemtic Name: 1-(3-methylbutyl)-3-(quinolin-2-ylcarbonylamino)thiourea Openeye Name: 1-isopentyl-3-(quinoline-2-carbonylamino)thiourea CAS Name: 1-(3-methylbutyl)-3-[[oxo(2-quinolinyl)methyl]amino]thiourea IUPAC Name: 1-(3-methylbutyl)-3-(quinoline-2-carbonylamino)thiourea Traditional Name: 1-isoamyl-3-(quinaldoylamino)thiourea Formula: C16H20N4OS MolecularWeight: 316.4212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=S)NNC(=O)C1=NC2=CC=CC=C2C=C1

Isomeric SMILES

CC(C)CCNC(=S)NNC(=O)C1=NC2=CC=CC=C2C=C1

InChI

InChI=1S/C16H20N4OS/c1-11(2)9-10-17-16(22)20-19-15(21)14-8-7-12-5-3-4-6-13(12)18-14/h3-8,11H,9-10H2,1-2H3,(H,19,21)(H2,17,20,22)