4-azanyl-5-chloranyl-N-[1-[3-(3-ethyl-2-oxidanylidene-benzimidazol-1-yl)propyl]-3-methoxy-piperidin-4-yl]-2-methoxy-benzamide hydrate

Systemtic Name: 4-azanyl-5-chloranyl-N-[1-[3-(3-ethyl-2-oxidanylidene-benzimidazol-1-yl)propyl]-3-methoxy-piperidin-4-yl]-2-methoxy-benzamide hydrate Openeye Name: 4-amino-5-chloro-N-[1-[3-(3-ethyl-2-oxo-benzimidazol-1-yl)propyl]-3-methoxy-4-piperidyl]-2-methoxy-benzamide hydrate CAS Name: 4-amino-5-chloro-N-[1-[3-(3-ethyl-2-oxo-1-benzimidazolyl)propyl]-3-methoxy-4-piperidinyl]-2-methoxybenzamide hydrate IUPAC Name: 4-amino-5-chloro-N-[1-[3-(3-ethyl-2-oxobenzimidazol-1-yl)propyl]-3-methoxypiperidin-4-yl]-2-methoxybenzamide hydrate Traditional Name: 4-amino-5-chloro-N-[1-[3-(3-ethyl-2-keto-benzimidazol-1-yl)propyl]-3-methoxy-4-piperidyl]-2-methoxy-benzamide hydrate Formula: C26H36ClN5O5 MolecularWeight: 534.04754

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N(C1=O)CCCN3CCC(C(C3)OC)NC(=O)C4=CC(=C(C=C4OC)N)Cl.O

Isomeric SMILES

CCN1C2=CC=CC=C2N(C1=O)CCCN3CCC(C(C3)OC)NC(=O)C4=CC(=C(C=C4OC)N)Cl.O

InChI

InChI=1S/C26H34ClN5O4.H2O/c1-4-31-21-8-5-6-9-22(21)32(26(31)34)12-7-11-30-13-10-20(24(16-30)36-3)29-25(33)17-14-18(27)19(28)15-23(17)35-2;/h5-6,8-9,14-15,20,24H,4,7,10-13,16,28H2,1-3H3,(H,29,33);1H2