1-ethyl-3-[1-methyl-2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]benzimidazol-5-yl]thiourea

Systemtic Name: 1-ethyl-3-[1-methyl-2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]benzimidazol-5-yl]thiourea Openeye Name: 1-ethyl-3-[1-methyl-2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]benzimidazol-5-yl]thiourea CAS Name: 1-ethyl-3-[1-methyl-2-[[(4-methyl-2-pyrimidinyl)thio]methyl]-5-benzimidazolyl]thiourea IUPAC Name: 1-ethyl-3-[1-methyl-2-[(4-methylpyrimidin-2-yl)sulfanylmethyl]benzimidazol-5-yl]thiourea Traditional Name: 1-ethyl-3-[1-methyl-2-[[(4-methylpyrimidin-2-yl)thio]methyl]benzimidazol-5-yl]thiourea Formula: C17H20N6S2 MolecularWeight: 372.5109

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NC1=CC2=C(C=C1)N(C(=N2)CSC3=NC=CC(=N3)C)C

Isomeric SMILES

CCNC(=S)NC1=CC2=C(C=C1)N(C(=N2)CSC3=NC=CC(=N3)C)C

InChI

InChI=1S/C17H20N6S2/c1-4-18-16(24)21-12-5-6-14-13(9-12)22-15(23(14)3)10-25-17-19-8-7-11(2)20-17/h5-9H,4,10H2,1-3H3,(H2,18,21,24)