1-(2-diethylaminoethyl)-3-(4-methyl-2-pyrrolidin-1-yl-quinolin-6-yl)thiourea

Systemtic Name: 1-(2-diethylaminoethyl)-3-(4-methyl-2-pyrrolidin-1-yl-quinolin-6-yl)thiourea Openeye Name: 1-(2-diethylaminoethyl)-3-(4-methyl-2-pyrrolidin-1-yl-6-quinolyl)thiourea CAS Name: 1-(2-diethylaminoethyl)-3-[4-methyl-2-(1-pyrrolidinyl)-6-quinolinyl]thiourea IUPAC Name: 1-(2-diethylaminoethyl)-3-(4-methyl-2-pyrrolidin-1-ylquinolin-6-yl)thiourea Traditional Name: 1-(2-diethylaminoethyl)-3-(4-methyl-2-pyrrolidino-6-quinolyl)thiourea Formula: C21H31N5S MolecularWeight: 385.56934

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=S)NC1=CC2=C(C=C1)N=C(C=C2C)N3CCCC3

Isomeric SMILES

CCN(CC)CCNC(=S)NC1=CC2=C(C=C1)N=C(C=C2C)N3CCCC3

InChI

InChI=1S/C21H31N5S/c1-4-25(5-2)13-10-22-21(27)23-17-8-9-19-18(15-17)16(3)14-20(24-19)26-11-6-7-12-26/h8-9,14-15H,4-7,10-13H2,1-3H3,(H2,22,23,27)