1-cyclopentyl-3-[3-(dimethylamino)propyl]-1-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea

Systemtic Name: 1-cyclopentyl-3-[3-(dimethylamino)propyl]-1-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]thiourea Openeye Name: 1-cyclopentyl-3-[3-(dimethylamino)propyl]-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea CAS Name: 1-cyclopentyl-3-[3-(dimethylamino)propyl]-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea IUPAC Name: 1-cyclopentyl-3-[3-(dimethylamino)propyl]-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]thiourea Traditional Name: 1-cyclopentyl-3-[3-(dimethylamino)propyl]-1-[(2-keto-8-methyl-1H-quinolin-3-yl)methyl]thiourea Formula: C22H32N4OS MolecularWeight: 400.58068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=O)C(=C2)CN(C3CCCC3)C(=S)NCCCN(C)C

Isomeric SMILES

CC1=CC=CC2=C1NC(=O)C(=C2)CN(C3CCCC3)C(=S)NCCCN(C)C

InChI

InChI=1S/C22H32N4OS/c1-16-8-6-9-17-14-18(21(27)24-20(16)17)15-26(19-10-4-5-11-19)22(28)23-12-7-13-25(2)3/h6,8-9,14,19H,4-5,7,10-13,15H2,1-3H3,(H,23,28)(H,24,27)