1-[5-(1-adamantylmethyl)-1-(2-hydroxyethyl)-2,4-bis(oxidanylidene)-1,5-benzodiazepin-3-yl]-3-phenyl-urea

Systemtic Name: 1-[5-(1-adamantylmethyl)-1-(2-hydroxyethyl)-2,4-bis(oxidanylidene)-1,5-benzodiazepin-3-yl]-3-phenyl-urea Openeye Name: 1-[5-(1-adamantylmethyl)-1-(2-hydroxyethyl)-2,4-dioxo-1,5-benzodiazepin-3-yl]-3-phenyl-urea CAS Name: 1-[5-(1-adamantylmethyl)-1-(2-hydroxyethyl)-2,4-dioxo-1,5-benzodiazepin-3-yl]-3-phenylurea IUPAC Name: 1-[5-(1-adamantylmethyl)-1-(2-hydroxyethyl)-2,4-dioxo-1,5-benzodiazepin-3-yl]-3-phenylurea Traditional Name: 1-[5-(1-adamantylmethyl)-1-(2-hydroxyethyl)-2,4-diketo-1,5-benzodiazepin-3-yl]-3-phenyl-urea Formula: C29H34N4O4 MolecularWeight: 502.60466

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CN4C5=CC=CC=C5N(C(=O)C(C4=O)NC(=O)NC6=CC=CC=C6)CCO

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CN4C5=CC=CC=C5N(C(=O)C(C4=O)NC(=O)NC6=CC=CC=C6)CCO

InChI

InChI=1S/C29H34N4O4/c34-11-10-32-23-8-4-5-9-24(23)33(18-29-15-19-12-20(16-29)14-21(13-19)17-29)27(36)25(26(32)35)31-28(37)30-22-6-2-1-3-7-22/h1-9,19-21,25,34H,10-18H2,(H2,30,31,37)