2-(2-chlorophenyl)-4-propan-2-ylsulfanyl-6-pyrrolidin-1-yl-pyrimidine

Systemtic Name: 2-(2-chlorophenyl)-4-propan-2-ylsulfanyl-6-pyrrolidin-1-yl-pyrimidine Openeye Name: 2-(2-chlorophenyl)-4-isopropylsulfanyl-6-pyrrolidin-1-yl-pyrimidine CAS Name: 2-(2-chlorophenyl)-4-(propan-2-ylthio)-6-(1-pyrrolidinyl)pyrimidine IUPAC Name: 2-(2-chlorophenyl)-4-propan-2-ylsulfanyl-6-pyrrolidin-1-ylpyrimidine Traditional Name: 2-(2-chlorophenyl)-4-(isopropylthio)-6-pyrrolidino-pyrimidine Formula: C17H20ClN3S MolecularWeight: 333.8788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NC(=NC(=C1)N2CCCC2)C3=CC=CC=C3Cl

Isomeric SMILES

CC(C)SC1=NC(=NC(=C1)N2CCCC2)C3=CC=CC=C3Cl

InChI

InChI=1S/C17H20ClN3S/c1-12(2)22-16-11-15(21-9-5-6-10-21)19-17(20-16)13-7-3-4-8-14(13)18/h3-4,7-8,11-12H,5-6,9-10H2,1-2H3