3-[(2S)-butan-2-yl]-1-(2-diethylaminoethyl)-1-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea

Systemtic Name: 3-[(2S)-butan-2-yl]-1-(2-diethylaminoethyl)-1-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea Openeye Name: 1-(2-diethylaminoethyl)-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-[(1S)-1-methylpropyl]thiourea CAS Name: 3-[(2S)-butan-2-yl]-1-(2-diethylaminoethyl)-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea IUPAC Name: 3-[(2S)-butan-2-yl]-1-(2-diethylaminoethyl)-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 1-(2-diethylaminoethyl)-1-[(2-keto-8-methyl-1H-quinolin-3-yl)methyl]-3-[(1S)-1-methylpropyl]thiourea Formula: C22H34N4OS MolecularWeight: 402.59656

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=S)N(CCN(CC)CC)CC1=CC2=C(C(=CC=C2)C)NC1=O

Isomeric SMILES

CC[C@H](C)NC(=S)N(CCN(CC)CC)CC1=CC2=C(C(=CC=C2)C)NC1=O

InChI

InChI=1S/C22H34N4OS/c1-6-17(5)23-22(28)26(13-12-25(7-2)8-3)15-19-14-18-11-9-10-16(4)20(18)24-21(19)27/h9-11,14,17H,6-8,12-13,15H2,1-5H3,(H,23,28)(H,24,27)/t17-/m0/s1