N-(1,2-benzoxazol-3-ylmethyl)-3-[(2-chlorophenyl)methyl]-1,3-diazinane-1-carboxamide

Systemtic Name: N-(1,2-benzoxazol-3-ylmethyl)-3-[(2-chlorophenyl)methyl]-1,3-diazinane-1-carboxamide Openeye Name: N-(1,2-benzoxazol-3-ylmethyl)-3-[(2-chlorophenyl)methyl]hexahydropyrimidine-1-carboxamide CAS Name: N-(1,2-benzoxazol-3-ylmethyl)-3-[(2-chlorophenyl)methyl]-1,3-diazinane-1-carboxamide IUPAC Name: N-(1,2-benzoxazol-3-ylmethyl)-3-[(2-chlorophenyl)methyl]-1,3-diazinane-1-carboxamide Traditional Name: 3-(2-chlorobenzyl)-N-(indoxazen-3-ylmethyl)hexahydropyrimidine-1-carboxamide Formula: C20H21ClN4O2 MolecularWeight: 384.85934

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CN(C1)C(=O)NCC2=NOC3=CC=CC=C32)CC4=CC=CC=C4Cl

Isomeric SMILES

C1CN(CN(C1)C(=O)NCC2=NOC3=CC=CC=C32)CC4=CC=CC=C4Cl

InChI

InChI=1S/C20H21ClN4O2/c21-17-8-3-1-6-15(17)13-24-10-5-11-25(14-24)20(26)22-12-18-16-7-2-4-9-19(16)27-23-18/h1-4,6-9H,5,10-14H2,(H,22,26)