1-(2-dimethylaminoethyl)-1-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-[[(2R)-oxolan-2-yl]methyl]thiourea

Systemtic Name: 1-(2-dimethylaminoethyl)-1-[(8-methyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-[[(2R)-oxolan-2-yl]methyl]thiourea Openeye Name: 1-(2-dimethylaminoethyl)-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea CAS Name: 1-(2-dimethylaminoethyl)-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-[[(2R)-2-oxolanyl]methyl]thiourea IUPAC Name: 1-(2-dimethylaminoethyl)-1-[(8-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-[[(2R)-oxolan-2-yl]methyl]thiourea Traditional Name: 1-(2-dimethylaminoethyl)-1-[(2-keto-8-methyl-1H-quinolin-3-yl)methyl]-3-[[(2R)-tetrahydrofuran-2-yl]methyl]thiourea Formula: C21H30N4O2S MolecularWeight: 402.5535

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=O)C(=C2)CN(CCN(C)C)C(=S)NCC3CCCO3

Isomeric SMILES

CC1=CC=CC2=C1NC(=O)C(=C2)CN(CCN(C)C)C(=S)NC[C@H]3CCCO3

InChI

InChI=1S/C21H30N4O2S/c1-15-6-4-7-16-12-17(20(26)23-19(15)16)14-25(10-9-24(2)3)21(28)22-13-18-8-5-11-27-18/h4,6-7,12,18H,5,8-11,13-14H2,1-3H3,(H,22,28)(H,23,26)/t18-/m1/s1