4-(1H-indol-2-ylcarbonyl)-1-[(2-methyl-1,3-thiazol-4-yl)methyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 4-(1H-indol-2-ylcarbonyl)-1-[(2-methyl-1,3-thiazol-4-yl)methyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 4-(1H-indole-2-carbonyl)-1-[(2-methylthiazol-4-yl)methyl]-6-(4-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 4-[1H-indol-2-yl(oxo)methyl]-1-[(2-methyl-4-thiazolyl)methyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one IUPAC Name: 4-(1H-indole-2-carbonyl)-1-[(2-methyl-1,3-thiazol-4-yl)methyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 4-(1H-indole-2-carbonyl)-1-[(2-methylthiazol-4-yl)methyl]-6-(4-pyridylmethoxy)-1,4-diazepan-2-one Formula: C25H25N5O3S MolecularWeight: 475.5627

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CN2CC(CN(CC2=O)C(=O)C3=CC4=CC=CC=C4N3)OCC5=CC=NC=C5

Isomeric SMILES

CC1=NC(=CS1)CN2CC(CN(CC2=O)C(=O)C3=CC4=CC=CC=C4N3)OCC5=CC=NC=C5

InChI

InChI=1S/C25H25N5O3S/c1-17-27-20(16-34-17)11-29-12-21(33-15-18-6-8-26-9-7-18)13-30(14-24(29)31)25(32)23-10-19-4-2-3-5-22(19)28-23/h2-10,16,21,28H,11-15H2,1H3