4-butan-2-ylsulfanyl-1-methyl-3-propan-2-yl-5-[(pyridin-4-ylmethylamino)methyl]imidazol-2-one

Systemtic Name: 4-butan-2-ylsulfanyl-1-methyl-3-propan-2-yl-5-[(pyridin-4-ylmethylamino)methyl]imidazol-2-one Openeye Name: 1-isopropyl-3-methyl-4-[(4-pyridylmethylamino)methyl]-5-sec-butylsulfanyl-imidazol-2-one CAS Name: 4-(butan-2-ylthio)-1-methyl-3-propan-2-yl-5-[(pyridin-4-ylmethylamino)methyl]-2-imidazolone IUPAC Name: 4-butan-2-ylsulfanyl-1-methyl-3-propan-2-yl-5-[(pyridin-4-ylmethylamino)methyl]imidazol-2-one Traditional Name: 1-isopropyl-3-methyl-4-[(4-pyridylmethylamino)methyl]-5-(sec-butylthio)-4-imidazolin-2-one Formula: C18H28N4OS MolecularWeight: 348.50612

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=C(N(C(=O)N1C(C)C)C)CNCC2=CC=NC=C2

Isomeric SMILES

CCC(C)SC1=C(N(C(=O)N1C(C)C)C)CNCC2=CC=NC=C2

InChI

InChI=1S/C18H28N4OS/c1-6-14(4)24-17-16(21(5)18(23)22(17)13(2)3)12-20-11-15-7-9-19-10-8-15/h7-10,13-14,20H,6,11-12H2,1-5H3