1-[(2-methyl-1,3-oxazol-5-yl)methyl]-N-(1-methylpiperidin-4-yl)benzimidazol-2-amine trihydrate

Systemtic Name: 1-[(2-methyl-1,3-oxazol-5-yl)methyl]-N-(1-methylpiperidin-4-yl)benzimidazol-2-amine trihydrate Openeye Name: 1-[(2-methyloxazol-5-yl)methyl]-N-(1-methyl-4-piperidyl)benzimidazol-2-amine trihydrate CAS Name: 1-[(2-methyl-5-oxazolyl)methyl]-N-(1-methyl-4-piperidinyl)-2-benzimidazolamine trihydrate IUPAC Name: 1-[(2-methyl-1,3-oxazol-5-yl)methyl]-N-(1-methylpiperidin-4-yl)benzimidazol-2-amine trihydrate Traditional Name: [1-[(2-methyloxazol-5-yl)methyl]benzimidazol-2-yl]-(1-methyl-4-piperidyl)amine trihydrate Formula: C18H29N5O4 MolecularWeight: 379.45396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(O1)CN2C3=CC=CC=C3N=C2NC4CCN(CC4)C.O.O.O

Isomeric SMILES

CC1=NC=C(O1)CN2C3=CC=CC=C3N=C2NC4CCN(CC4)C.O.O.O

InChI

InChI=1S/C18H23N5O.3H2O/c1-13-19-11-15(24-13)12-23-17-6-4-3-5-16(17)21-18(23)20-14-7-9-22(2)10-8-14;;;/h3-6,11,14H,7-10,12H2,1-2H3,(H,20,21);3*1H2