N-[1-(2-azanylethyl)piperidin-4-yl]-1-[(2-methyl-1,3-oxazol-5-yl)methyl]benzimidazol-2-amine hydrate

Systemtic Name: N-[1-(2-azanylethyl)piperidin-4-yl]-1-[(2-methyl-1,3-oxazol-5-yl)methyl]benzimidazol-2-amine hydrate Openeye Name: N-[1-(2-aminoethyl)-4-piperidyl]-1-[(2-methyloxazol-5-yl)methyl]benzimidazol-2-amine hydrate CAS Name: N-[1-(2-aminoethyl)-4-piperidinyl]-1-[(2-methyl-5-oxazolyl)methyl]-2-benzimidazolamine hydrate IUPAC Name: N-[1-(2-aminoethyl)piperidin-4-yl]-1-[(2-methyl-1,3-oxazol-5-yl)methyl]benzimidazol-2-amine hydrate Traditional Name: [1-(2-aminoethyl)-4-piperidyl]-[1-[(2-methyloxazol-5-yl)methyl]benzimidazol-2-yl]amine hydrate Formula: C19H28N6O2 MolecularWeight: 372.46462

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N6O.H2O/c1-14-21-12-16(26-14)13-25-18-5-3-2-4-17(18)23-19(25)22-15-6-9-24(10-7-15)11-8-20;/h2-5,12,15H,6-11,13,20H2,1H3,(H,22,23);1H2