1-[[2-[4-[(2S)-butan-2-yl]phenyl]quinolin-4-yl]carbonylamino]-3-methyl-thiourea

Systemtic Name: 1-[[2-[4-[(2S)-butan-2-yl]phenyl]quinolin-4-yl]carbonylamino]-3-methyl-thiourea Openeye Name: 1-methyl-3-[[2-[4-[(1S)-1-methylpropyl]phenyl]quinoline-4-carbonyl]amino]thiourea CAS Name: 1-[[[2-[4-[(2S)-butan-2-yl]phenyl]-4-quinolinyl]-oxomethyl]amino]-3-methylthiourea IUPAC Name: 1-[[2-[4-[(2S)-butan-2-yl]phenyl]quinoline-4-carbonyl]amino]-3-methylthiourea Traditional Name: 1-methyl-3-[[2-[4-[(1S)-1-methylpropyl]phenyl]quinoline-4-carbonyl]amino]thiourea Formula: C22H24N4OS MolecularWeight: 392.51716

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NNC(=S)NC

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NNC(=S)NC

InChI

InChI=1S/C22H24N4OS/c1-4-14(2)15-9-11-16(12-10-15)20-13-18(21(27)25-26-22(28)23-3)17-7-5-6-8-19(17)24-20/h5-14H,4H2,1-3H3,(H,25,27)(H2,23,26,28)/t14-/m0/s1