3-hexyl-1-[4-(1H-imidazol-5-ylmethyl)-2,3-dihydro-1,4-benzoxazin-6-yl]-1-methyl-urea

Systemtic Name: 3-hexyl-1-[4-(1H-imidazol-5-ylmethyl)-2,3-dihydro-1,4-benzoxazin-6-yl]-1-methyl-urea Openeye Name: 3-hexyl-1-[4-(1H-imidazol-5-ylmethyl)-2,3-dihydro-1,4-benzoxazin-6-yl]-1-methyl-urea CAS Name: 3-hexyl-1-[4-(1H-imidazol-5-ylmethyl)-2,3-dihydro-1,4-benzoxazin-6-yl]-1-methylurea IUPAC Name: 3-hexyl-1-[4-(1H-imidazol-5-ylmethyl)-2,3-dihydro-1,4-benzoxazin-6-yl]-1-methylurea Traditional Name: 3-hexyl-1-[4-(1H-imidazol-5-ylmethyl)-2,3-dihydro-1,4-benzoxazin-6-yl]-1-methyl-urea Formula: C20H29N5O2 MolecularWeight: 371.47656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)N(C)C1=CC2=C(C=C1)OCCN2CC3=CN=CN3

Isomeric SMILES

CCCCCCNC(=O)N(C)C1=CC2=C(C=C1)OCCN2CC3=CN=CN3

InChI

InChI=1S/C20H29N5O2/c1-3-4-5-6-9-22-20(26)24(2)17-7-8-19-18(12-17)25(10-11-27-19)14-16-13-21-15-23-16/h7-8,12-13,15H,3-6,9-11,14H2,1-2H3,(H,21,23)(H,22,26)