1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-3-(4-methyl-2-pyrrolidin-1-yl-quinolin-6-yl)thiourea

Systemtic Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-3-(4-methyl-2-pyrrolidin-1-yl-quinolin-6-yl)thiourea Openeye Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-3-(4-methyl-2-pyrrolidin-1-yl-6-quinolyl)thiourea CAS Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-3-[4-methyl-2-(1-pyrrolidinyl)-6-quinolinyl]thiourea IUPAC Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-3-(4-methyl-2-pyrrolidin-1-ylquinolin-6-yl)thiourea Traditional Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-3-(4-methyl-2-pyrrolidino-6-quinolyl)thiourea Formula: C26H31N5S MolecularWeight: 445.62284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=C(C=C2)NC(=S)NCCN3CCC4=CC=CC=C4C3)N5CCCC5

Isomeric SMILES

CC1=CC(=NC2=C1C=C(C=C2)NC(=S)NCCN3CCC4=CC=CC=C4C3)N5CCCC5

InChI

InChI=1S/C26H31N5S/c1-19-16-25(31-12-4-5-13-31)29-24-9-8-22(17-23(19)24)28-26(32)27-11-15-30-14-10-20-6-2-3-7-21(20)18-30/h2-3,6-9,16-17H,4-5,10-15,18H2,1H3,(H2,27,28,32)